1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine

C14H19N3 — CID 62133485

IUPAC1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine
SMILESCC(CCc1ccccc1)Nc1nccn1C
InChIInChI=1S/C14H19N3/c1-12(16-14-15-10-11-17(14)2)8-9-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3,(H,15,16)
InChIKeyFGRPIFZVRRTBGG-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.85
Rot. Bonds5

About 1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine

1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine (PubChem CID 62133485) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine.

Molecular Properties

Compound Name1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine
PubChem CID62133485
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine
SMILESCC(CCc1ccccc1)Nc1nccn1C
InChIInChI=1S/C14H19N3/c1-12(16-14-15-10-11-17(14)2)8-9-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3,(H,15,16)
InChIKeyFGRPIFZVRRTBGG-UHFFFAOYSA-N
XLogP2.85
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1-methylimidazol-2-yl)ethyl]-4-phenylbutan-2-amine
CID 61213282
N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyridin-5-amine
CID 102625526
N-(1-methoxypropan-2-yl)-1-(4-phenylbutan-2-yl)imidazol-2-amine
CID 106567227
1-N,1-N-dimethyl-2-N-(1-methylimidazol-2-yl)propane-1,2-diamine
CID 82937558
2-N-methyl-6-N-(4-phenylbutan-2-yl)pyridine-2,6-diamine
CID 80811958
N-ethyl-1-(1-methylimidazol-2-yl)-3-phenylpropan-1-amine
CID 63974955
6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine
CID 79954125
(2S)-2-amino-N-(1-methylimidazol-2-yl)-3-phenylpropanamide
CID 15837349
1-[(R)-(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-3-[(2S)-4-phenylbutan-2-yl]urea
CID 36508070
5-chloro-2-N-methyl-4-N-(4-phenylbutan-2-yl)pyrimidine-2,4-diamine
CID 80811720
N-(4-phenylbutan-2-yl)quinolin-8-amine
CID 43098678
6-hydrazinyl-N-(4-phenylbutan-2-yl)pyridin-2-amine
CID 80903512

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine?
The IUPAC name of 1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine (CID 62133485) is 1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine.
What is the SMILES notation for 1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine?
The canonical SMILES for 1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine is CC(CCc1ccccc1)Nc1nccn1C.
What is the InChIKey of 1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine?
The InChIKey is FGRPIFZVRRTBGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-12(16-14-15-10-11-17(14)2)8-9-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3,(H,15,16).
What are the key properties of 1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine?
1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine has a molecular weight of 229.33 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine is sourced from PubChem (CID 62133485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).