5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine

C14H16N2 — CID 115748884

IUPAC5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine
SMILESCc1cncc(NCc2ccccc2C)c1
InChIInChI=1S/C14H16N2/c1-11-7-14(10-15-8-11)16-9-13-6-4-3-5-12(13)2/h3-8,10,16H,9H2,1-2H3
InChIKeyGOGONDBTHFLWLD-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.31
Rot. Bonds3

About 5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine

5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine (PubChem CID 115748884) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine
PubChem CID115748884
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine
SMILESCc1cncc(NCc2ccccc2C)c1
InChIInChI=1S/C14H16N2/c1-11-7-14(10-15-8-11)16-9-13-6-4-3-5-12(13)2/h3-8,10,16H,9H2,1-2H3
InChIKeyGOGONDBTHFLWLD-UHFFFAOYSA-N
XLogP3.31
TPSA24.92 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 ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine?
The IUPAC name of 5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine (CID 115748884) is 5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine.
What is the SMILES notation for 5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine?
The canonical SMILES for 5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine is Cc1cncc(NCc2ccccc2C)c1.
What is the InChIKey of 5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine?
The InChIKey is GOGONDBTHFLWLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-11-7-14(10-15-8-11)16-9-13-6-4-3-5-12(13)2/h3-8,10,16H,9H2,1-2H3.
What are the key properties of 5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine?
5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine has a molecular weight of 212.30 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(2-methylphenyl)methyl]pyridin-3-amine is sourced from PubChem (CID 115748884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).