2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide

C17H15N3O — CID 121470684

IUPAC2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide
SMILESCc1ccc2ccc(-c3c(C(N)=O)ccnc3C)cc2n1
InChIInChI=1S/C17H15N3O/c1-10-3-4-12-5-6-13(9-15(12)20-10)16-11(2)19-8-7-14(16)17(18)21/h3-9H,1-2H3,(H2,18,21)
InChIKeyCEZNFCHDYKALNN-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.01
Rot. Bonds2

About 2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide

2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide (PubChem CID 121470684) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide
PubChem CID121470684
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide
SMILESCc1ccc2ccc(-c3c(C(N)=O)ccnc3C)cc2n1
InChIInChI=1S/C17H15N3O/c1-10-3-4-12-5-6-13(9-15(12)20-10)16-11(2)19-8-7-14(16)17(18)21/h3-9H,1-2H3,(H2,18,21)
InChIKeyCEZNFCHDYKALNN-UHFFFAOYSA-N
XLogP3.01
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide?
The IUPAC name of 2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide (CID 121470684) is 2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide is Cc1ccc2ccc(-c3c(C(N)=O)ccnc3C)cc2n1.
What is the InChIKey of 2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide?
The InChIKey is CEZNFCHDYKALNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-10-3-4-12-5-6-13(9-15(12)20-10)16-11(2)19-8-7-14(16)17(18)21/h3-9H,1-2H3,(H2,18,21).
What are the key properties of 2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide?
2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide has a molecular weight of 277.33 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(2-methylquinolin-7-yl)pyridine-4-carboxamide is sourced from PubChem (CID 121470684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).