1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine

C14H19N3 — CID 43749763

IUPAC1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine
SMILESCC(Cn1ccnc1)NC(C)c1ccccc1
InChIInChI=1S/C14H19N3/c1-12(10-17-9-8-15-11-17)16-13(2)14-6-4-3-5-7-14/h3-9,11-13,16H,10H2,1-2H3
InChIKeyHONINRAKVCYRBL-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.62
Rot. Bonds5

About 1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine

1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine (PubChem CID 43749763) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine.

Molecular Properties

Compound Name1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine
PubChem CID43749763
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine
SMILESCC(Cn1ccnc1)NC(C)c1ccccc1
InChIInChI=1S/C14H19N3/c1-12(10-17-9-8-15-11-17)16-13(2)14-6-4-3-5-7-14/h3-9,11-13,16H,10H2,1-2H3
InChIKeyHONINRAKVCYRBL-UHFFFAOYSA-N
XLogP2.62
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 ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-imidazol-1-yl-N-[1-(4-propan-2-ylphenyl)ethyl]propan-2-amine
CID 43749714
4-[1-(1-imidazol-1-ylpropan-2-ylamino)ethyl]phenol
CID 43749727
1-imidazol-1-yl-N-[1-(3-methylphenyl)ethyl]propan-2-amine
CID 43791961
N-[1-(4-tert-butylphenyl)ethyl]-1-imidazol-1-ylpropan-2-amine
CID 43749787
3,3,3-trifluoro-N-(1-imidazol-1-ylpropan-2-yl)-1-phenylpropan-1-amine
CID 43792012
N-[1-(3,4-dimethoxyphenyl)ethyl]-1-imidazol-1-ylpropan-2-amine
CID 43749824
N-[1-(3-bromo-4-methoxyphenyl)ethyl]-1-imidazol-1-ylpropan-2-amine
CID 43791944
3-imidazol-1-yl-2-phenylpropan-1-amine
CID 64538242
2-imidazol-1-yl-1-phenylethanamine
CID 5195236
1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)propan-1-amine
CID 43749780
1-(2-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)propan-1-amine
CID 112631437
4-benzamido-N-[(2R)-1-imidazol-1-ylpropan-2-yl]benzamide
CID 94159344

Frequently Asked Questions

What is the IUPAC name of 1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine?
The IUPAC name of 1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine (CID 43749763) is 1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine.
What is the SMILES notation for 1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine?
The canonical SMILES for 1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine is CC(Cn1ccnc1)NC(C)c1ccccc1.
What is the InChIKey of 1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine?
The InChIKey is HONINRAKVCYRBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-12(10-17-9-8-15-11-17)16-13(2)14-6-4-3-5-7-14/h3-9,11-13,16H,10H2,1-2H3.
What are the key properties of 1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine?
1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine has a molecular weight of 229.33 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-imidazol-1-yl-N-(1-phenylethyl)propan-2-amine is sourced from PubChem (CID 43749763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).