1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine

C14H16N2 — CID 82542177

IUPAC1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine
SMILESCc1ccc(-c2cncc(C(C)N)c2)cc1
InChIInChI=1S/C14H16N2/c1-10-3-5-12(6-4-10)14-7-13(11(2)15)8-16-9-14/h3-9,11H,15H2,1-2H3
InChIKeyANUYOSPLMVEBFV-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.08
Rot. Bonds2

About 1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine

1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine (PubChem CID 82542177) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine.

Molecular Properties

Compound Name1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine
PubChem CID82542177
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine
SMILESCc1ccc(-c2cncc(C(C)N)c2)cc1
InChIInChI=1S/C14H16N2/c1-10-3-5-12(6-4-10)14-7-13(11(2)15)8-16-9-14/h3-9,11H,15H2,1-2H3
InChIKeyANUYOSPLMVEBFV-UHFFFAOYSA-N
XLogP3.08
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine 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

(1S)-1-(5-phenyl-3-pyridinyl)ethanamine
CID 96702221
1-[5-(2-methoxy-5-methylphenyl)-3-pyridinyl]ethanamine
CID 82541817
1-[5-(1-methylpyrazol-4-yl)-3-pyridinyl]ethanamine
CID 82542206
5-[(1R)-1-aminoethyl]pyridin-3-amine
CID 55275207
3-(4-methoxyphenyl)-5-propan-2-ylpyridine
CID 59144720
1-(5-bromo-3-pyridinyl)ethanamine;dihydrochloride
CID 138110830
3-methyl-5-(4-methylphenyl)pyridine;4-(4-methylphenyl)pyridine
CID 143453970
6-[5-(1-aminoethyl)-3-pyridinyl]-1-methyl-3,4-dihydroquinolin-2-one;methane;hydrochloride
CID 159930466
3-[5-(4-fluorophenyl)-3-pyridinyl]butan-1-amine
CID 82542814
1-[5-(5-methyl-3-pyridinyl)thiophen-2-yl]ethanamine
CID 107586222
(1S)-1-[5-[5-[(1S)-1-hydroxy-2-methylpropyl]-3-pyridinyl]-3-pyridinyl]-2-methylpropan-1-ol
CID 11335596
1-(5-ethynyl-3-pyridinyl)ethanamine
CID 74788737

Frequently Asked Questions

What is the IUPAC name of 1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine?
The IUPAC name of 1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine (CID 82542177) is 1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine.
What is the SMILES notation for 1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine?
The canonical SMILES for 1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine is Cc1ccc(-c2cncc(C(C)N)c2)cc1.
What is the InChIKey of 1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine?
The InChIKey is ANUYOSPLMVEBFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-10-3-5-12(6-4-10)14-7-13(11(2)15)8-16-9-14/h3-9,11H,15H2,1-2H3.
What are the key properties of 1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine?
1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine has a molecular weight of 212.30 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(4-methylphenyl)-3-pyridinyl]ethanamine is sourced from PubChem (CID 82542177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).