4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine

C19H18N2O — CID 178203209

IUPAC4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine
SMILESCc1c(N)cncc1-c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C19H18N2O/c1-14-18(11-21-12-19(14)20)16-8-5-9-17(10-16)22-13-15-6-3-2-4-7-15/h2-12H,13,20H2,1H3
InChIKeyXJSIMKBJIDDXQH-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.22
Rot. Bonds4

About 4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine

4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine (PubChem CID 178203209) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine.

Molecular Properties

Compound Name4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine
PubChem CID178203209
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine
SMILESCc1c(N)cncc1-c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C19H18N2O/c1-14-18(11-21-12-19(14)20)16-8-5-9-17(10-16)22-13-15-6-3-2-4-7-15/h2-12H,13,20H2,1H3
InChIKeyXJSIMKBJIDDXQH-UHFFFAOYSA-N
XLogP4.22
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine?
The IUPAC name of 4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine (CID 178203209) is 4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine.
What is the SMILES notation for 4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine?
The canonical SMILES for 4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine is Cc1c(N)cncc1-c1cccc(OCc2ccccc2)c1.
What is the InChIKey of 4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine?
The InChIKey is XJSIMKBJIDDXQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-14-18(11-21-12-19(14)20)16-8-5-9-17(10-16)22-13-15-6-3-2-4-7-15/h2-12H,13,20H2,1H3.
What are the key properties of 4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine?
4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine has a molecular weight of 290.37 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(3-phenylmethoxyphenyl)pyridin-3-amine is sourced from PubChem (CID 178203209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).