3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine

C20H20N2 — CID 11594452

IUPAC3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine
SMILESCc1ccc(CCc2cccc(-c3ccccc3)c2)nc1N
InChIInChI=1S/C20H20N2/c1-15-10-12-19(22-20(15)21)13-11-16-6-5-9-18(14-16)17-7-3-2-4-8-17/h2-10,12,14H,11,13H2,1H3,(H2,21,22)
InChIKeyJMBOMPONAQVGDC-UHFFFAOYSA-N
MW288.39 g/mol
LogP4.42
Rot. Bonds4

About 3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine

3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine (PubChem CID 11594452) has the molecular formula C20H20N2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine
PubChem CID11594452
Molecular FormulaC20H20N2
Molecular Weight288.39 g/mol
Exact Mass288.16
IUPAC Name3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine
SMILESCc1ccc(CCc2cccc(-c3ccccc3)c2)nc1N
InChIInChI=1S/C20H20N2/c1-15-10-12-19(22-20(15)21)13-11-16-6-5-9-18(14-16)17-7-3-2-4-8-17/h2-10,12,14H,11,13H2,1H3,(H2,21,22)
InChIKeyJMBOMPONAQVGDC-UHFFFAOYSA-N
XLogP4.42
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine?
The IUPAC name of 3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine (CID 11594452) is 3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine.
What is the SMILES notation for 3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine?
The canonical SMILES for 3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine is Cc1ccc(CCc2cccc(-c3ccccc3)c2)nc1N.
What is the InChIKey of 3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine?
The InChIKey is JMBOMPONAQVGDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2/c1-15-10-12-19(22-20(15)21)13-11-16-6-5-9-18(14-16)17-7-3-2-4-8-17/h2-10,12,14H,11,13H2,1H3,(H2,21,22).
What are the key properties of 3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine?
3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine has a molecular weight of 288.39 g/mol, XLogP of 4.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-[2-(3-phenylphenyl)ethyl]pyridin-2-amine is sourced from PubChem (CID 11594452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).