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

C170H342N26O8S4 — CID 159635895

IUPACN-[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
SMILESCC(C)(C)NC1CCC(NS(C)(=O)=O)CC1.CC(C)(C)NC1CCCC1.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCN1.CC(C)(C)NC1CCCCO1.CC(C)(C)NC1CCCN1.CC(C)(C)NC1CCCO1.CC(C)(C)NC1CCCOC1.CC(C)(C)NC1CCCS1.CC(C)(C)NC1CCNCC1.CC(C)(C)NC1CCOC1.CC(C)(C)NC1CCOCC1.CC(C)(C)NC1CCSC1.CC(C)(C)NCC1CCOC1.CC(C)(C)NCC1CCSC1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccn1.CC(C)(C)Nc1cccnc1.CC(C)(C)Nc1ccncc1
InChIInChI=1S/C11H24N2O2S.C10H21N.C10H15N.C9H20N2.2C9H14N2.C9H20N2.C9H14N2.4C9H19NO.C9H19NS.C9H19N.C8H18N2.2C8H17NO.2C8H17NS/c1-11(2,3)12-9-5-7-10(8-6-9)13-16(4,14)15;2*1-10(2,3)11-9-7-5-4-6-8-9;2*1-9(2,3)11-8-4-6-10-7-5-8;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)10-8-4-6-11-7-5-8;1-9(2,3)10-6-8-4-5-11-7-8;1-9(2,3)10-8-5-4-6-11-7-8;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)10-8-6-4-5-7-8;1-8(2,3)10-7-5-4-6-9-7;1-8(2,3)9-7-4-5-10-6-7;1-8(2,3)9-7-5-4-6-10-7;1-8(2,3)9-7-4-5-10-6-7;1-8(2,3)9-7-5-4-6-10-7/h9-10,12-13H,5-8H2,1-4H3;9,11H,4-8H2,1-3H3;4-8,11H,1-3H3;8,10-11H,4-7H2,1-3H3;4-7H,1-3H3,(H,10,11);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;8,10H,4-7H2,1-3H3;7,9-10H,4-6H2,1-3H3;4*7,9H,4-6H2,1-3H3
InChIKeyMPSVFDPERDEZSR-UHFFFAOYSA-N
MW3007.05 g/mol
LogP35.05
Rot. Bonds23

About 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

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 (PubChem CID 159635895) has the molecular formula C170H342N26O8S4 and a molecular weight of 3007.05 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound NameN-[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
PubChem CID159635895
Molecular FormulaC170H342N26O8S4
Molecular Weight3007.05 g/mol
Exact Mass3004.60
IUPAC NameN-[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
SMILESCC(C)(C)NC1CCC(NS(C)(=O)=O)CC1.CC(C)(C)NC1CCCC1.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCN1.CC(C)(C)NC1CCCCO1.CC(C)(C)NC1CCCN1.CC(C)(C)NC1CCCO1.CC(C)(C)NC1CCCOC1.CC(C)(C)NC1CCCS1.CC(C)(C)NC1CCNCC1.CC(C)(C)NC1CCOC1.CC(C)(C)NC1CCOCC1.CC(C)(C)NC1CCSC1.CC(C)(C)NCC1CCOC1.CC(C)(C)NCC1CCSC1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccn1.CC(C)(C)Nc1cccnc1.CC(C)(C)Nc1ccncc1
InChIInChI=1S/C11H24N2O2S.C10H21N.C10H15N.C9H20N2.2C9H14N2.C9H20N2.C9H14N2.4C9H19NO.C9H19NS.C9H19N.C8H18N2.2C8H17NO.2C8H17NS/c1-11(2,3)12-9-5-7-10(8-6-9)13-16(4,14)15;2*1-10(2,3)11-9-7-5-4-6-8-9;2*1-9(2,3)11-8-4-6-10-7-5-8;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)10-8-4-6-11-7-5-8;1-9(2,3)10-6-8-4-5-11-7-8;1-9(2,3)10-8-5-4-6-11-7-8;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)10-8-6-4-5-7-8;1-8(2,3)10-7-5-4-6-9-7;1-8(2,3)9-7-4-5-10-6-7;1-8(2,3)9-7-5-4-6-10-7;1-8(2,3)9-7-4-5-10-6-7;1-8(2,3)9-7-5-4-6-10-7/h9-10,12-13H,5-8H2,1-4H3;9,11H,4-8H2,1-3H3;4-8,11H,1-3H3;8,10-11H,4-7H2,1-3H3;4-7H,1-3H3,(H,10,11);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;8,10H,4-7H2,1-3H3;7,9-10H,4-6H2,1-3H3;4*7,9H,4-6H2,1-3H3
InChIKeyMPSVFDPERDEZSR-UHFFFAOYSA-N
XLogP35.05
TPSA404.88 Ų
H-Bond Donors23
H-Bond Acceptors36
Rotatable Bonds23
Heavy Atoms208
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003007.05
LogP ≤ 535.05
H-Bond Donors ≤ 523
H-Bond Acceptors ≤ 1036

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC(C)(C)NC1CCC(NS(C)(=O)=O)CC1.CC(C)(C)NC1CCCC1.CC(C)(C)NC1CCCCC1.CC(C)(C)NC1CCCCN1.CC(C)(C)NC1CCCCO1.CC(C)(C)NC1CCCN1.CC(C)(C)NC1CCCO1.CC(C)(C)NC1CCCOC1.CC(C)(C)NC1CCCS1.CC(C)(C)NC1CCNCC1.CC(C)(C)NC1CCOC1.CC(C)(C)NC1CCOCC1.CC(C)(C)NC1CCSC1.CC(C)(C)NCC1CCOC1.CC(C)(C)NCC1CCSC1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccn1.CC(C)(C)Nc1cccnc1.CC(C)(C)Nc1ccncc1.
What is the InChIKey of 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?
The InChIKey is MPSVFDPERDEZSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S.C10H21N.C10H15N.C9H20N2.2C9H14N2.C9H20N2.C9H14N2.4C9H19NO.C9H19NS.C9H19N.C8H18N2.2C8H17NO.2C8H17NS/c1-11(2,3)12-9-5-7-10(8-6-9)13-16(4,14)15;2*1-10(2,3)11-9-7-5-4-6-8-9;2*1-9(2,3)11-8-4-6-10-7-5-8;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)10-8-4-6-11-7-5-8;1-9(2,3)10-6-8-4-5-11-7-8;1-9(2,3)10-8-5-4-6-11-7-8;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)10-8-6-4-5-7-8;1-8(2,3)10-7-5-4-6-9-7;1-8(2,3)9-7-4-5-10-6-7;1-8(2,3)9-7-5-4-6-10-7;1-8(2,3)9-7-4-5-10-6-7;1-8(2,3)9-7-5-4-6-10-7/h9-10,12-13H,5-8H2,1-4H3;9,11H,4-8H2,1-3H3;4-8,11H,1-3H3;8,10-11H,4-7H2,1-3H3;4-7H,1-3H3,(H,10,11);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;8,10H,4-7H2,1-3H3;7,9-10H,4-6H2,1-3H3;4*7,9H,4-6H2,1-3H3.
What are the key properties of 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?
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 has a molecular weight of 3007.05 g/mol, XLogP of 35.05, 23 rotatable bonds, 23 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159635895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).