N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine

C161H271N35O2S4 — CID 158142560

IUPACN-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine
SMILESC.CC.CC.CC(C)(C)NCc1ccccc1.CC(C)(C)NCc1ccccn1.CC(C)(C)NCc1cccs1.CC(C)(C)NCc1ccncc1.CC(C)(C)NCc1cscn1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccn1.CC(C)(C)Nc1ccncc1.CC(C)(C)Nc1cnccn1.CC(C)(C)Nc1cocn1.CC(C)(C)Nc1cscn1.CC(C)(C)Nc1ncccn1.CC(C)(C)Nc1ncco1.CC(C)(C)Nc1nccs1.Cn1ccnc1NC(C)(C)C.Cn1cnc(NC(C)(C)C)c1
InChIInChI=1S/C11H17N.2C10H16N2.3C10H15N.2C9H14N2.C9H15NS.2C8H15N3.2C8H13N3.C8H14N2S.2C7H12N2O.2C7H12N2S.2C2H6.CH4/c1-11(2,3)12-9-10-7-5-4-6-8-10;1-10(2,3)12-8-9-4-6-11-7-5-9;1-10(2,3)12-8-9-6-4-5-7-11-9;3*1-10(2,3)11-9-7-5-4-6-8-9;1-9(2,3)11-8-4-6-10-7-5-8;1-9(2,3)11-8-6-4-5-7-10-8;1-9(2,3)10-7-8-5-4-6-11-8;1-8(2,3)10-7-5-11(4)6-9-7;1-8(2,3)10-7-9-5-6-11(7)4;1-8(2,3)11-7-6-9-4-5-10-7;1-8(2,3)11-7-9-5-4-6-10-7;1-8(2,3)10-4-7-5-11-6-9-7;1-7(2,3)9-6-4-10-5-8-6;1-7(2,3)9-6-8-4-5-10-6;1-7(2,3)9-6-4-10-5-8-6;1-7(2,3)9-6-8-4-5-10-6;2*1-2;/h4-8,12H,9H2,1-3H3;2*4-7,12H,8H2,1-3H3;3*4-8,11H,1-3H3;2*4-7H,1-3H3,(H,10,11);4-6,10H,7H2,1-3H3;5-6,10H,1-4H3;5-6H,1-4H3,(H,9,10);4-6H,1-3H3,(H,10,11);4-6H,1-3H3,(H,9,10,11);5-6,10H,4H2,1-3H3;4-5,9H,1-3H3;4-5H,1-3H3,(H,8,9);4-5,9H,1-3H3;4-5H,1-3H3,(H,8,9);2*1-2H3;1H4
InChIKeyFUCSVHOQCFHPOS-UHFFFAOYSA-N
MW2857.45 g/mol
LogP42.26
Rot. Bonds23

About N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine

N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine (PubChem CID 158142560) has the molecular formula C161H271N35O2S4 and a molecular weight of 2857.45 g/mol. Its IUPAC name is N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine.

Molecular Properties

Compound NameN-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine
PubChem CID158142560
Molecular FormulaC161H271N35O2S4
Molecular Weight2857.45 g/mol
Exact Mass2855.11
IUPAC NameN-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine
SMILESC.CC.CC.CC(C)(C)NCc1ccccc1.CC(C)(C)NCc1ccccn1.CC(C)(C)NCc1cccs1.CC(C)(C)NCc1ccncc1.CC(C)(C)NCc1cscn1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccn1.CC(C)(C)Nc1ccncc1.CC(C)(C)Nc1cnccn1.CC(C)(C)Nc1cocn1.CC(C)(C)Nc1cscn1.CC(C)(C)Nc1ncccn1.CC(C)(C)Nc1ncco1.CC(C)(C)Nc1nccs1.Cn1ccnc1NC(C)(C)C.Cn1cnc(NC(C)(C)C)c1
InChIInChI=1S/C11H17N.2C10H16N2.3C10H15N.2C9H14N2.C9H15NS.2C8H15N3.2C8H13N3.C8H14N2S.2C7H12N2O.2C7H12N2S.2C2H6.CH4/c1-11(2,3)12-9-10-7-5-4-6-8-10;1-10(2,3)12-8-9-4-6-11-7-5-9;1-10(2,3)12-8-9-6-4-5-7-11-9;3*1-10(2,3)11-9-7-5-4-6-8-9;1-9(2,3)11-8-4-6-10-7-5-8;1-9(2,3)11-8-6-4-5-7-10-8;1-9(2,3)10-7-8-5-4-6-11-8;1-8(2,3)10-7-5-11(4)6-9-7;1-8(2,3)10-7-9-5-6-11(7)4;1-8(2,3)11-7-6-9-4-5-10-7;1-8(2,3)11-7-9-5-4-6-10-7;1-8(2,3)10-4-7-5-11-6-9-7;1-7(2,3)9-6-4-10-5-8-6;1-7(2,3)9-6-8-4-5-10-6;1-7(2,3)9-6-4-10-5-8-6;1-7(2,3)9-6-8-4-5-10-6;2*1-2;/h4-8,12H,9H2,1-3H3;2*4-7,12H,8H2,1-3H3;3*4-8,11H,1-3H3;2*4-7H,1-3H3,(H,10,11);4-6,10H,7H2,1-3H3;5-6,10H,1-4H3;5-6H,1-4H3,(H,9,10);4-6H,1-3H3,(H,10,11);4-6H,1-3H3,(H,9,10,11);5-6,10H,4H2,1-3H3;4-5,9H,1-3H3;4-5H,1-3H3,(H,8,9);4-5,9H,1-3H3;4-5H,1-3H3,(H,8,9);2*1-2H3;1H4
InChIKeyFUCSVHOQCFHPOS-UHFFFAOYSA-N
XLogP42.26
TPSA446.03 Ų
H-Bond Donors18
H-Bond Acceptors41
Rotatable Bonds23
Heavy Atoms202
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002857.45
LogP ≤ 542.26
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1041

Analyze N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine with MolForge

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Related Compounds

azetidine;benzene;3,3-difluoropyrrolidine;N,N-dimethylcyclohexanamine;2,6-dimethylpyridine;3,3-dimethylpyrrolidine;3-fluoropyrrolidine;bis(1H-imidazole);1-methylazetidine;methylcyclohexane;tris(1-methylimidazole);1-methylpiperazine;bis(1-methylpiperidine);bis(1-methylpyrrolidine);2-methyl-1,3-thiazole;morpholine;1,3-oxazole;piperidine;bis(pyridine);pyrrolidine;1,3-thiazole
CID 157320197
3,3-difluoro-1-methylpyrrolidine;1,3-dimethylazetidine;1,4-dimethylcyclohexane;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;1,4-dimethylpiperazine;1,3-dimethylpiperidine;1,4-dimethylpiperidine;1,2-dimethylpyrrolidine;1,3-dimethylpyrrolidine;2,4-dimethyl-1,3-thiazole;3-fluoro-1-methylpyrrolidine;1-methylazetidine;1-methylimidazole;2-methyl-1H-imidazole;4-methylmorpholine;2-methyl-1,3-oxazole;1-methylpiperidine;2-methylpyridine;4-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;toluene;N,N,4-trimethylcyclohexan-1-amine;2,4,6-trimethylpyridine;1,3,3-trimethylpyrrolidine
CID 157790631
3,3-difluoro-1-methylpyrrolidine;1,3-dimethylazetidine;1,4-dimethylcyclohexane;1,2-dimethylimidazole;1,5-dimethylimidazole;1,4-dimethylpiperazine;1,3-dimethylpiperidine;1,4-dimethylpiperidine;1,3-dimethylpyrrole;1,2-dimethylpyrrolidine;1,3-dimethylpyrrolidine;2,4-dimethyl-1,3-thiazole;3-fluoro-1-methylpyrrolidine;1-methylazetidine;1-methylimidazole;2-methyl-1H-imidazole;4-methylmorpholine;2-methyl-1,3-oxazole;1-methylpiperidine;2-methylpyridine;4-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;toluene;N,N,4-trimethylcyclohexan-1-amine;2,4,6-trimethylpyridine;1,3,3-trimethylpyrrolidine
CID 160631338
[(2S)-2-[[(5-ethyl-2-pyridinyl)amino]methyl]pyrrolidin-1-yl]-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methanone;[(2S,3R)-2-[[(5-ethylpyrimidin-2-yl)amino]methyl]-3-methylpiperidin-1-yl]-(6-phenylimidazo[2,1-b][1,3]oxazol-5-yl)methanone;[(2S,3R)-2-[[(5-ethylpyrimidin-2-yl)amino]methyl]-3-methylpiperidin-1-yl]-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methanone;[(2S,3R)-3-methyl-2-[[(5-methyl-2-pyridinyl)amino]methyl]piperidin-1-yl]-(6-phenylimidazo[2,1-b][1,3]oxazol-5-yl)methanone;[(2S,3R)-3-methyl-2-[[[5-(trifluoromethyl)-2-pyridinyl]amino]methyl]piperidin-1-yl]-(6-phenylimidazo[2,1-b][1,3]oxazol-5-yl)methanone
CID 167568722
[(2S)-2-[[(5-ethyl-2-pyridinyl)amino]methyl]pyrrolidin-1-yl]-(6-phenylimidazo[2,1-b][1,3]oxazol-5-yl)methanone;[(2S)-2-[[(5-ethyl-2-pyridinyl)amino]methyl]pyrrolidin-1-yl]-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methanone;[(2S,3R)-2-[[(5-ethylpyrimidin-2-yl)amino]methyl]-3-methylpiperidin-1-yl]-(6-phenylimidazo[2,1-b][1,3]oxazol-5-yl)methanone;[(2S,3R)-3-methyl-2-[[[5-(trifluoromethyl)-2-pyridinyl]amino]methyl]piperidin-1-yl]-(6-phenylimidazo[2,1-b][1,3]oxazol-5-yl)methanone
CID 167667579
6-[[1-[2-[[4-Amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]-4-pyridinyl]pyridin-1-ium-3-yl]methyl]-2-(1,3-oxazol-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 90946857
6-Butylsulfinyl-2-(1-methylimidazol-2-yl)-4-phenylthieno[2,3-d]pyrimidin-5-amine;6-butylsulfinyl-2-(1,3-oxazol-4-yl)-4-phenylthieno[2,3-d]pyrimidin-5-amine;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-amine;2-(3-methoxypropylsulfinyl)-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-amine;4-(1-methylimidazol-2-yl)-2-propan-2-ylsulfinyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-amine
CID 157213480
CID 157255402
CID 157255402
1-(Cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;3-(3-methylbutyl)-1,3-oxazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-oxazol-3-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-oxazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-oxazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium
CID 157345363
3-[5-(1,3-Benzothiazol-3-ium-3-yl)-3-pyridinyl]-1,3-benzothiazol-3-ium;3-[5-(1,3-oxazol-3-ium-3-yl)-3-pyridinyl]-1,3-oxazol-3-ium;3-[6-(1,3-oxazol-3-ium-3-yl)pyrimidin-4-yl]-1,3-oxazol-3-ium;3-[3-phenyl-5-(1,3-thiazol-3-ium-3-yl)phenyl]-1,3-thiazol-3-ium
CID 157403747
tert-butylbenzene;2-tert-butylpyrazine;2-tert-butyl-1,3,4-thiadiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;octakis(2,2-dimethylpropane);1H-imidazole;methane;1,3-oxazole;pyridine;2H-pyrrole;3H-pyrrolo[3,2-b]pyridine;bis(7H-pyrrolo[3,4-d]pyrimidine);1,3-thiazole
CID 157417324
tert-butylbenzene;2-tert-butylpyrazine;2-tert-butyl-1,3,4-thiadiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;octakis(2,2-dimethylpropane);1H-imidazole;methane;1,3-oxazole;pyridine;2H-pyrrole;bis(7H-pyrrolo[3,4-d]pyrimidine);1,3-thiazole;[1,3]thiazolo[5,4-b]pyridine
CID 157726544

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine?
The IUPAC name of N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine (CID 158142560) is N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine.
What is the SMILES notation for N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine?
The canonical SMILES for N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine is C.CC.CC.CC(C)(C)NCc1ccccc1.CC(C)(C)NCc1ccccn1.CC(C)(C)NCc1cccs1.CC(C)(C)NCc1ccncc1.CC(C)(C)NCc1cscn1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccc1.CC(C)(C)Nc1ccccn1.CC(C)(C)Nc1ccncc1.CC(C)(C)Nc1cnccn1.CC(C)(C)Nc1cocn1.CC(C)(C)Nc1cscn1.CC(C)(C)Nc1ncccn1.CC(C)(C)Nc1ncco1.CC(C)(C)Nc1nccs1.Cn1ccnc1NC(C)(C)C.Cn1cnc(NC(C)(C)C)c1.
What is the InChIKey of N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine?
The InChIKey is FUCSVHOQCFHPOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N.2C10H16N2.3C10H15N.2C9H14N2.C9H15NS.2C8H15N3.2C8H13N3.C8H14N2S.2C7H12N2O.2C7H12N2S.2C2H6.CH4/c1-11(2,3)12-9-10-7-5-4-6-8-10;1-10(2,3)12-8-9-4-6-11-7-5-9;1-10(2,3)12-8-9-6-4-5-7-11-9;3*1-10(2,3)11-9-7-5-4-6-8-9;1-9(2,3)11-8-4-6-10-7-5-8;1-9(2,3)11-8-6-4-5-7-10-8;1-9(2,3)10-7-8-5-4-6-11-8;1-8(2,3)10-7-5-11(4)6-9-7;1-8(2,3)10-7-9-5-6-11(7)4;1-8(2,3)11-7-6-9-4-5-10-7;1-8(2,3)11-7-9-5-4-6-10-7;1-8(2,3)10-4-7-5-11-6-9-7;1-7(2,3)9-6-4-10-5-8-6;1-7(2,3)9-6-8-4-5-10-6;1-7(2,3)9-6-4-10-5-8-6;1-7(2,3)9-6-8-4-5-10-6;2*1-2;/h4-8,12H,9H2,1-3H3;2*4-7,12H,8H2,1-3H3;3*4-8,11H,1-3H3;2*4-7H,1-3H3,(H,10,11);4-6,10H,7H2,1-3H3;5-6,10H,1-4H3;5-6H,1-4H3,(H,9,10);4-6H,1-3H3,(H,10,11);4-6H,1-3H3,(H,9,10,11);5-6,10H,4H2,1-3H3;4-5,9H,1-3H3;4-5H,1-3H3,(H,8,9);4-5,9H,1-3H3;4-5H,1-3H3,(H,8,9);2*1-2H3;1H4.
What are the key properties of N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine?
N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine has a molecular weight of 2857.45 g/mol, XLogP of 42.26, 23 rotatable bonds, 18 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-methylpropan-2-amine;tris(N-tert-butylaniline);N-tert-butyl-1-methylimidazol-2-amine;N-tert-butyl-1-methylimidazol-4-amine;N-tert-butyl-1,3-oxazol-2-amine;N-tert-butyl-1,3-oxazol-4-amine;N-tert-butylpyrazin-2-amine;N-tert-butylpyridin-2-amine;N-tert-butylpyridin-4-amine;N-tert-butylpyrimidin-2-amine;N-tert-butyl-1,3-thiazol-2-amine;N-tert-butyl-1,3-thiazol-4-amine;ethane;methane;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;2-methyl-N-(1,3-thiazol-4-ylmethyl)propan-2-amine;2-methyl-N-(thiophen-2-ylmethyl)propan-2-amine is sourced from PubChem (CID 158142560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).