bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine

C250H516N30O5S2 — CID 162003192

IUPACbis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCN1.CC(C)(C)NC1CCCCO1.CC(C)(C)NCC1CCCC1.CC(C)(C)NCC1CCCCC1.CC(C)(C)NCC1CCCCC1.CC(C)(C)NCC1CCCCC1.CC(C)(C)NCC1CCCCN1.CC(C)(C)NCC1CCCCO1.CC(C)(C)NCC1CCCN1.CC(C)(C)NCC1CCCO1.CC(C)(C)NCC1CCCOC1.CC(C)(C)NCC1CCCS1.CC(C)(C)NCC1CCOC1.CC(C)(C)NCC1CCSC1.CC(C)(C)NCc1ccccc1.CC(C)(C)NCc1ccccc1.CC(C)(C)NCc1ccccn1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccn1.CC(C)(C)Nc1cccnc1
InChIInChI=1S/3C11H23N.2C11H17N.C10H22N2.C10H16N2.2C10H21NO.4C10H21N.2C10H15N.C9H20N2.C9H14N2.C9H20N2.C9H14N2.3C9H19NO.2C9H19NS.14CH4/c5*1-11(2,3)12-9-10-7-5-4-6-8-10;2*1-10(2,3)12-8-9-6-4-5-7-11-9;1-10(2,3)11-7-9-5-4-6-12-8-9;1-10(2,3)11-8-9-6-4-5-7-12-9;1-10(2,3)11-8-9-6-4-5-7-9;5*1-10(2,3)11-9-7-5-4-6-8-9;1-9(2,3)11-7-8-5-4-6-10-8;1-9(2,3)11-8-5-4-6-10-7-8;2*1-9(2,3)11-8-6-4-5-7-10-8;1-9(2,3)10-6-8-4-5-11-7-8;1-9(2,3)10-7-8-5-4-6-11-8;1-9(2,3)10-8-6-4-5-7-11-8;1-9(2,3)10-6-8-4-5-11-7-8;1-9(2,3)10-7-8-5-4-6-11-8;;;;;;;;;;;;;;/h3*10,12H,4-9H2,1-3H3;2*4-8,12H,9H2,1-3H3;9,11-12H,4-8H2,1-3H3;4-7,12H,8H2,1-3H3;2*9,11H,4-8H2,1-3H3;4*9,11H,4-8H2,1-3H3;2*4-8,11H,1-3H3;8,10-11H,4-7H2,1-3H3;4-7,11H,1-3H3;8,10-11H,4-7H2,1-3H3;4-7H,1-3H3,(H,10,11);5*8,10H,4-7H2,1-3H3;14*1H4
InChIKeyYSMJOFISRRHYRY-UHFFFAOYSA-N
MW4087.22 g/mol
LogP63.08
Rot. Bonds39

About bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine

bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine (PubChem CID 162003192) has the molecular formula C250H516N30O5S2 and a molecular weight of 4087.22 g/mol. Its IUPAC name is bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine.

Molecular Properties

Compound Namebis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine
PubChem CID162003192
Molecular FormulaC250H516N30O5S2
Molecular Weight4087.22 g/mol
Exact Mass4084.05
IUPAC Namebis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCN1.CC(C)(C)NC1CCCCO1.CC(C)(C)NCC1CCCC1.CC(C)(C)NCC1CCCCC1.CC(C)(C)NCC1CCCCC1.CC(C)(C)NCC1CCCCC1.CC(C)(C)NCC1CCCCN1.CC(C)(C)NCC1CCCCO1.CC(C)(C)NCC1CCCN1.CC(C)(C)NCC1CCCO1.CC(C)(C)NCC1CCCOC1.CC(C)(C)NCC1CCCS1.CC(C)(C)NCC1CCOC1.CC(C)(C)NCC1CCSC1.CC(C)(C)NCc1ccccc1.CC(C)(C)NCc1ccccc1.CC(C)(C)NCc1ccccn1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccn1.CC(C)(C)Nc1cccnc1
InChIInChI=1S/3C11H23N.2C11H17N.C10H22N2.C10H16N2.2C10H21NO.4C10H21N.2C10H15N.C9H20N2.C9H14N2.C9H20N2.C9H14N2.3C9H19NO.2C9H19NS.14CH4/c5*1-11(2,3)12-9-10-7-5-4-6-8-10;2*1-10(2,3)12-8-9-6-4-5-7-11-9;1-10(2,3)11-7-9-5-4-6-12-8-9;1-10(2,3)11-8-9-6-4-5-7-12-9;1-10(2,3)11-8-9-6-4-5-7-9;5*1-10(2,3)11-9-7-5-4-6-8-9;1-9(2,3)11-7-8-5-4-6-10-8;1-9(2,3)11-8-5-4-6-10-7-8;2*1-9(2,3)11-8-6-4-5-7-10-8;1-9(2,3)10-6-8-4-5-11-7-8;1-9(2,3)10-7-8-5-4-6-11-8;1-9(2,3)10-8-6-4-5-7-11-8;1-9(2,3)10-6-8-4-5-11-7-8;1-9(2,3)10-7-8-5-4-6-11-8;;;;;;;;;;;;;;/h3*10,12H,4-9H2,1-3H3;2*4-8,12H,9H2,1-3H3;9,11-12H,4-8H2,1-3H3;4-7,12H,8H2,1-3H3;2*9,11H,4-8H2,1-3H3;4*9,11H,4-8H2,1-3H3;2*4-8,11H,1-3H3;8,10-11H,4-7H2,1-3H3;4-7,11H,1-3H3;8,10-11H,4-7H2,1-3H3;4-7H,1-3H3,(H,10,11);5*8,10H,4-7H2,1-3H3;14*1H4
InChIKeyYSMJOFISRRHYRY-UHFFFAOYSA-N
XLogP63.08
TPSA409.63 Ų
H-Bond Donors27
H-Bond Acceptors37
Rotatable Bonds39
Heavy Atoms287
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004087.22
LogP ≤ 563.08
H-Bond Donors ≤ 527
H-Bond Acceptors ≤ 1037

Analyze bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine with MolForge

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Launch Full Analysis

Related Compounds

bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butylcyclopentanamine;N-tert-butyl-3-methylcyclohexan-1-amine;N-tert-butyl-4-methylcyclohexan-1-amine;N-tert-butyloxan-2-amine;N-tert-butyloxan-3-amine;N-tert-butyloxolan-2-amine;N-tert-butyloxolan-3-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;N-tert-butylpyrrolidin-2-amine;N-tert-butylthiolan-2-amine;N-tert-butylthiolan-3-amine;methane;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine
CID 157476482
bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butylcyclopentanamine;N-tert-butyloxan-2-amine;N-tert-butyloxan-3-amine;N-tert-butyloxolan-2-amine;N-tert-butyloxolan-3-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;N-tert-butylpyrrolidin-2-amine;N-tert-butylthiolan-2-amine;N-tert-butylthiolan-3-amine;N-(cyclopentylmethyl)-2-methylpropan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine
CID 157811987
N,N-dimethyl-2-(4-propan-2-ylpiperazin-1-yl)ethanamine;4-(1,1-dioxo-1,4-thiazinan-4-yl)-N-propan-2-ylaniline;6-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-3-amine;N-(2-morpholin-4-ylethyl)propan-2-amine;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine;N-(oxolan-2-ylmethyl)propan-2-amine;N-(2-phenylethyl)propan-2-amine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-(2-pyridin-2-ylethyl)piperazine;N-propan-2-ylpyrrolidin-3-amine;1-propan-2-ylpyrrolidine;1-propan-2-yl-4-(2-thiophen-2-ylethyl)piperazine;N-(2-pyrrolidin-1-ylethyl)propan-2-amine;N-(pyrrolidin-2-ylmethyl)propan-2-amine;N-(2-thiomorpholin-4-ylethyl)propan-2-amine
CID 157955540
N-(cyclopentylmethyl)propan-2-amine;1-methyl-4-[5-(2-methylpropyl)-2-pyridinyl]piperazine;4-methylpentylbenzene;4-(4-methylpentyl)morpholine;4-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrrolidine;4-(4-methylpentyl)thiomorpholine;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine;N-(oxolan-2-ylmethyl)propan-2-amine;3-piperidin-1-yl-N-propan-2-ylpropan-1-amine;N-propan-2-ylcyclopentanamine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine;1-propan-2-yl-4-(2-thiophen-2-ylethyl)piperazine
CID 158347388
N,N-dimethyl-2-(4-propan-2-ylpiperazin-1-yl)ethanamine;6-(4-methylpiperazin-1-yl)-N-propan-2-ylpyridin-3-amine;N-(2-morpholin-4-ylethyl)propan-2-amine;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine;N-(oxolan-2-ylmethyl)propan-2-amine;N-(2-phenylethyl)propan-2-amine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-yl-4-(2-pyridin-2-ylethyl)piperazine;N-propan-2-ylpyrrolidin-3-amine;1-propan-2-ylpyrrolidine;1-propan-2-yl-4-(2-thiophen-2-ylethyl)piperazine;N-(2-pyrrolidin-1-ylethyl)propan-2-amine;N-(pyrrolidin-2-ylmethyl)propan-2-amine;N-(2-thiomorpholin-4-ylethyl)propan-2-amine
CID 159078006
bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butyloxan-3-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine
CID 159087833
N-[4-(tert-butylamino)cyclohexyl]methanesulfonamide;N-tert-butylaniline;N-tert-butylcyclohexanamine;N-tert-butylcyclopentanamine;N-tert-butyloxan-2-amine;N-tert-butyloxan-3-amine;N-tert-butyloxan-4-amine;N-tert-butyloxolan-2-amine;N-tert-butyloxolan-3-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpiperidin-4-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrrolidin-2-amine;N-tert-butylthiolan-2-amine;N-tert-butylthiolan-3-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine
CID 159635895

Frequently Asked Questions

What is the IUPAC name of bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine?
The IUPAC name of bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine (CID 162003192) is bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine.
What is the SMILES notation for bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine?
The canonical SMILES for bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine is C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCN1.CC(C)(C)NC1CCCCO1.CC(C)(C)NCC1CCCC1.CC(C)(C)NCC1CCCCC1.CC(C)(C)NCC1CCCCC1.CC(C)(C)NCC1CCCCC1.CC(C)(C)NCC1CCCCN1.CC(C)(C)NCC1CCCCO1.CC(C)(C)NCC1CCCN1.CC(C)(C)NCC1CCCO1.CC(C)(C)NCC1CCCOC1.CC(C)(C)NCC1CCCS1.CC(C)(C)NCC1CCOC1.CC(C)(C)NCC1CCSC1.CC(C)(C)NCc1ccccc1.CC(C)(C)NCc1ccccc1.CC(C)(C)NCc1ccccn1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccn1.CC(C)(C)Nc1cccnc1.
What is the InChIKey of bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine?
The InChIKey is YSMJOFISRRHYRY-UHFFFAOYSA-N. The full InChI is InChI=1S/3C11H23N.2C11H17N.C10H22N2.C10H16N2.2C10H21NO.4C10H21N.2C10H15N.C9H20N2.C9H14N2.C9H20N2.C9H14N2.3C9H19NO.2C9H19NS.14CH4/c5*1-11(2,3)12-9-10-7-5-4-6-8-10;2*1-10(2,3)12-8-9-6-4-5-7-11-9;1-10(2,3)11-7-9-5-4-6-12-8-9;1-10(2,3)11-8-9-6-4-5-7-12-9;1-10(2,3)11-8-9-6-4-5-7-9;5*1-10(2,3)11-9-7-5-4-6-8-9;1-9(2,3)11-7-8-5-4-6-10-8;1-9(2,3)11-8-5-4-6-10-7-8;2*1-9(2,3)11-8-6-4-5-7-10-8;1-9(2,3)10-6-8-4-5-11-7-8;1-9(2,3)10-7-8-5-4-6-11-8;1-9(2,3)10-8-6-4-5-7-11-8;1-9(2,3)10-6-8-4-5-11-7-8;1-9(2,3)10-7-8-5-4-6-11-8;;;;;;;;;;;;;;/h3*10,12H,4-9H2,1-3H3;2*4-8,12H,9H2,1-3H3;9,11-12H,4-8H2,1-3H3;4-7,12H,8H2,1-3H3;2*9,11H,4-8H2,1-3H3;4*9,11H,4-8H2,1-3H3;2*4-8,11H,1-3H3;8,10-11H,4-7H2,1-3H3;4-7,11H,1-3H3;8,10-11H,4-7H2,1-3H3;4-7H,1-3H3,(H,10,11);5*8,10H,4-7H2,1-3H3;14*1H4.
What are the key properties of bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine?
bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine has a molecular weight of 4087.22 g/mol, XLogP of 63.08, 39 rotatable bonds, 27 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N-benzyl-2-methylpropan-2-amine);bis(N-tert-butylaniline);tris(N-tert-butylcyclohexanamine);N-tert-butyloxan-2-amine;N-tert-butylpiperidin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-3-amine;tris(N-(cyclohexylmethyl)-2-methylpropan-2-amine);N-(cyclopentylmethyl)-2-methylpropan-2-amine;methane;2-methyl-N-(oxan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxan-3-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-2-ylmethyl)propan-2-amine;2-methyl-N-(oxolan-3-ylmethyl)propan-2-amine;2-methyl-N-(piperidin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-2-ylmethyl)propan-2-amine;2-methyl-N-(thiolan-3-ylmethyl)propan-2-amine is sourced from PubChem (CID 162003192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).