2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide

C17H15N3O — CID 110856628

IUPAC2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1cc2cnccc2nc1C
InChIInChI=1S/C17H15N3O/c1-11-5-3-4-6-15(11)20-17(21)14-9-13-10-18-8-7-16(13)19-12(14)2/h3-10H,1-2H3,(H,20,21)
InChIKeyIJHYWAIFEQBANX-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.50
Rot. Bonds2

About 2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide

2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide (PubChem CID 110856628) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide
PubChem CID110856628
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1cc2cnccc2nc1C
InChIInChI=1S/C17H15N3O/c1-11-5-3-4-6-15(11)20-17(21)14-9-13-10-18-8-7-16(13)19-12(14)2/h3-10H,1-2H3,(H,20,21)
InChIKeyIJHYWAIFEQBANX-UHFFFAOYSA-N
XLogP3.50
TPSA54.88 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 ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide (CID 110856628) is 2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide is Cc1ccccc1NC(=O)c1cc2cnccc2nc1C.
What is the InChIKey of 2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide?
The InChIKey is IJHYWAIFEQBANX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-11-5-3-4-6-15(11)20-17(21)14-9-13-10-18-8-7-16(13)19-12(14)2/h3-10H,1-2H3,(H,20,21).
What are the key properties of 2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide?
2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide has a molecular weight of 277.33 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide is sourced from PubChem (CID 110856628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).