4-methyl-2-(2-phenylethyl)pyridin-3-amine

C14H16N2 — CID 158413024

IUPAC4-methyl-2-(2-phenylethyl)pyridin-3-amine
SMILESCc1ccnc(CCc2ccccc2)c1N
InChIInChI=1S/C14H16N2/c1-11-9-10-16-13(14(11)15)8-7-12-5-3-2-4-6-12/h2-6,9-10H,7-8,15H2,1H3
InChIKeyXLXHAGHUPVDSJK-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.76
Rot. Bonds3

About 4-methyl-2-(2-phenylethyl)pyridin-3-amine

4-methyl-2-(2-phenylethyl)pyridin-3-amine (PubChem CID 158413024) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 4-methyl-2-(2-phenylethyl)pyridin-3-amine.

Molecular Properties

Compound Name4-methyl-2-(2-phenylethyl)pyridin-3-amine
PubChem CID158413024
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name4-methyl-2-(2-phenylethyl)pyridin-3-amine
SMILESCc1ccnc(CCc2ccccc2)c1N
InChIInChI=1S/C14H16N2/c1-11-9-10-16-13(14(11)15)8-7-12-5-3-2-4-6-12/h2-6,9-10H,7-8,15H2,1H3
InChIKeyXLXHAGHUPVDSJK-UHFFFAOYSA-N
XLogP2.76
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(2-phenylethyl)pyridin-3-amine?
The IUPAC name of 4-methyl-2-(2-phenylethyl)pyridin-3-amine (CID 158413024) is 4-methyl-2-(2-phenylethyl)pyridin-3-amine.
What is the SMILES notation for 4-methyl-2-(2-phenylethyl)pyridin-3-amine?
The canonical SMILES for 4-methyl-2-(2-phenylethyl)pyridin-3-amine is Cc1ccnc(CCc2ccccc2)c1N.
What is the InChIKey of 4-methyl-2-(2-phenylethyl)pyridin-3-amine?
The InChIKey is XLXHAGHUPVDSJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-11-9-10-16-13(14(11)15)8-7-12-5-3-2-4-6-12/h2-6,9-10H,7-8,15H2,1H3.
What are the key properties of 4-methyl-2-(2-phenylethyl)pyridin-3-amine?
4-methyl-2-(2-phenylethyl)pyridin-3-amine has a molecular weight of 212.30 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(2-phenylethyl)pyridin-3-amine is sourced from PubChem (CID 158413024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).