4-phenyl-N-(2-phenylethyl)pentan-1-amine

C19H25N — CID 57323485

IUPAC4-phenyl-N-(2-phenylethyl)pentan-1-amine
SMILESCC(CCCNCCc1ccccc1)c1ccccc1
InChIInChI=1S/C19H25N/c1-17(19-12-6-3-7-13-19)9-8-15-20-16-14-18-10-4-2-5-11-18/h2-7,10-13,17,20H,8-9,14-16H2,1H3
InChIKeyUYPRSPQKJJWZME-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.40
Rot. Bonds8

About 4-phenyl-N-(2-phenylethyl)pentan-1-amine

4-phenyl-N-(2-phenylethyl)pentan-1-amine (PubChem CID 57323485) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 4-phenyl-N-(2-phenylethyl)pentan-1-amine.

Molecular Properties

Compound Name4-phenyl-N-(2-phenylethyl)pentan-1-amine
PubChem CID57323485
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name4-phenyl-N-(2-phenylethyl)pentan-1-amine
SMILESCC(CCCNCCc1ccccc1)c1ccccc1
InChIInChI=1S/C19H25N/c1-17(19-12-6-3-7-13-19)9-8-15-20-16-14-18-10-4-2-5-11-18/h2-7,10-13,17,20H,8-9,14-16H2,1H3
InChIKeyUYPRSPQKJJWZME-UHFFFAOYSA-N
XLogP4.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-phenyl-N-(2-phenylethyl)pentan-1-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

[(2R)-5-phenylpentan-2-yl]benzene
CID 143889057
6-phenylhexan-2-ylbenzene
CID 19704587
N-[2-(3-methylphenyl)ethyl]-3-phenylbutan-1-amine
CID 62313909
5-(3-phenylbutylamino)pentan-2-ol
CID 107272084
2-phenyl-N-(3-phenylpropyl)propan-1-amine;hydrochloride
CID 13011907
N,N'-bis(2-phenylethyl)octane-1,8-diamine;dihydrobromide
CID 3029610
3-phenyl-N-(2-phenylethyl)propan-1-amine;hydrochloride
CID 54603294
N,N'-bis(2-phenylethyl)heptane-1,7-diamine;dihydrobromide
CID 3028511
N-(3-phenylbutyl)hexan-1-amine
CID 63420973
N-butyl-N'-(2-phenylethyl)ethane-1,2-diamine
CID 54806957
(1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol
CID 94271411
N-(2-phenylethyl)-3-propan-2-yloxypropan-1-amine;hydrochloride
CID 17207061

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-(2-phenylethyl)pentan-1-amine?
The IUPAC name of 4-phenyl-N-(2-phenylethyl)pentan-1-amine (CID 57323485) is 4-phenyl-N-(2-phenylethyl)pentan-1-amine.
What is the SMILES notation for 4-phenyl-N-(2-phenylethyl)pentan-1-amine?
The canonical SMILES for 4-phenyl-N-(2-phenylethyl)pentan-1-amine is CC(CCCNCCc1ccccc1)c1ccccc1.
What is the InChIKey of 4-phenyl-N-(2-phenylethyl)pentan-1-amine?
The InChIKey is UYPRSPQKJJWZME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-17(19-12-6-3-7-13-19)9-8-15-20-16-14-18-10-4-2-5-11-18/h2-7,10-13,17,20H,8-9,14-16H2,1H3.
What are the key properties of 4-phenyl-N-(2-phenylethyl)pentan-1-amine?
4-phenyl-N-(2-phenylethyl)pentan-1-amine has a molecular weight of 267.42 g/mol, XLogP of 4.40, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-(2-phenylethyl)pentan-1-amine is sourced from PubChem (CID 57323485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).