2-methyl-1-(4-phenylphenyl)pentan-1-amine

C18H23N — CID 43094240

IUPAC2-methyl-1-(4-phenylphenyl)pentan-1-amine
SMILESCCCC(C)C(N)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H23N/c1-3-7-14(2)18(19)17-12-10-16(11-13-17)15-8-5-4-6-9-15/h4-6,8-14,18H,3,7,19H2,1-2H3
InChIKeyLMPAHUZUPLDUBL-UHFFFAOYSA-N
MW253.39 g/mol
LogP4.79
Rot. Bonds5

About 2-methyl-1-(4-phenylphenyl)pentan-1-amine

2-methyl-1-(4-phenylphenyl)pentan-1-amine (PubChem CID 43094240) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-methyl-1-(4-phenylphenyl)pentan-1-amine.

Molecular Properties

Compound Name2-methyl-1-(4-phenylphenyl)pentan-1-amine
PubChem CID43094240
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC Name2-methyl-1-(4-phenylphenyl)pentan-1-amine
SMILESCCCC(C)C(N)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H23N/c1-3-7-14(2)18(19)17-12-10-16(11-13-17)15-8-5-4-6-9-15/h4-6,8-14,18H,3,7,19H2,1-2H3
InChIKeyLMPAHUZUPLDUBL-UHFFFAOYSA-N
XLogP4.79
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-methyl-1-(4-phenylphenyl)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

1-(4-phenylphenyl)butan-1-amine
CID 43197430
2,2-diethoxy-1-(4-phenylphenyl)ethanamine
CID 79489021
2-methyl-1-[4-(2-methylpropoxy)phenyl]pentan-1-amine
CID 107886407
2-(4-phenylphenyl)pentan-3-amine
CID 79308070
1-hexan-2-yl-4-phenylbenzene
CID 57161678
2,6-dimethyl-1-phenylheptan-1-amine
CID 104845216
ethyl (3S)-3-amino-2-fluoro-3-(4-phenylphenyl)propanoate
CID 171249187
(1S)-1-(4-phenylphenyl)ethanamine;hydrochloride
CID 54594942
2-methyl-1-(2-methylphenyl)pentan-1-amine
CID 115794811
2-methyl-1-pyridin-3-ylpentan-1-amine
CID 115799302
azane;1,1'-biphenyl;butane
CID 155168826
4-(4-phenylphenyl)pentan-2-amine
CID 65456648

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(4-phenylphenyl)pentan-1-amine?
The IUPAC name of 2-methyl-1-(4-phenylphenyl)pentan-1-amine (CID 43094240) is 2-methyl-1-(4-phenylphenyl)pentan-1-amine.
What is the SMILES notation for 2-methyl-1-(4-phenylphenyl)pentan-1-amine?
The canonical SMILES for 2-methyl-1-(4-phenylphenyl)pentan-1-amine is CCCC(C)C(N)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-methyl-1-(4-phenylphenyl)pentan-1-amine?
The InChIKey is LMPAHUZUPLDUBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N/c1-3-7-14(2)18(19)17-12-10-16(11-13-17)15-8-5-4-6-9-15/h4-6,8-14,18H,3,7,19H2,1-2H3.
What are the key properties of 2-methyl-1-(4-phenylphenyl)pentan-1-amine?
2-methyl-1-(4-phenylphenyl)pentan-1-amine has a molecular weight of 253.39 g/mol, XLogP of 4.79, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(4-phenylphenyl)pentan-1-amine is sourced from PubChem (CID 43094240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).