N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine

C16H15N3 — CID 79238376

IUPACN-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine
SMILESCc1cc(CNc2cccnc2)c2ccccc2n1
InChIInChI=1S/C16H15N3/c1-12-9-13(10-18-14-5-4-8-17-11-14)15-6-2-3-7-16(15)19-12/h2-9,11,18H,10H2,1H3
InChIKeyUWSYPIUKFLYVHT-UHFFFAOYSA-N
MW249.32 g/mol
LogP3.55
Rot. Bonds3

About N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine

N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine (PubChem CID 79238376) has the molecular formula C16H15N3 and a molecular weight of 249.32 g/mol. Its IUPAC name is N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound NameN-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine
PubChem CID79238376
Molecular FormulaC16H15N3
Molecular Weight249.32 g/mol
Exact Mass249.13
IUPAC NameN-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine
SMILESCc1cc(CNc2cccnc2)c2ccccc2n1
InChIInChI=1S/C16H15N3/c1-12-9-13(10-18-14-5-4-8-17-11-14)15-6-2-3-7-16(15)19-12/h2-9,11,18H,10H2,1H3
InChIKeyUWSYPIUKFLYVHT-UHFFFAOYSA-N
XLogP3.55
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine?
The IUPAC name of N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine (CID 79238376) is N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine.
What is the SMILES notation for N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine?
The canonical SMILES for N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine is Cc1cc(CNc2cccnc2)c2ccccc2n1.
What is the InChIKey of N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine?
The InChIKey is UWSYPIUKFLYVHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3/c1-12-9-13(10-18-14-5-4-8-17-11-14)15-6-2-3-7-16(15)19-12/h2-9,11,18H,10H2,1H3.
What are the key properties of N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine?
N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine has a molecular weight of 249.32 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylquinolin-4-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 79238376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).