2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide

C22H18N4O — CID 46908965

IUPAC2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide
SMILESCc1nc2ncccc2cc1C(=O)NCc1ccc(-c2ccccc2)nc1
InChIInChI=1S/C22H18N4O/c1-15-19(12-18-8-5-11-23-21(18)26-15)22(27)25-14-16-9-10-20(24-13-16)17-6-3-2-4-7-17/h2-13H,14H2,1H3,(H,25,27)
InChIKeyPIZLEUHCHMWXCE-UHFFFAOYSA-N
MW354.41 g/mol
LogP3.93
Rot. Bonds4

About 2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide

2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide (PubChem CID 46908965) has the molecular formula C22H18N4O and a molecular weight of 354.41 g/mol. Its IUPAC name is 2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide
PubChem CID46908965
Molecular FormulaC22H18N4O
Molecular Weight354.41 g/mol
Exact Mass354.15
IUPAC Name2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide
SMILESCc1nc2ncccc2cc1C(=O)NCc1ccc(-c2ccccc2)nc1
InChIInChI=1S/C22H18N4O/c1-15-19(12-18-8-5-11-23-21(18)26-15)22(27)25-14-16-9-10-20(24-13-16)17-6-3-2-4-7-17/h2-13H,14H2,1H3,(H,25,27)
InChIKeyPIZLEUHCHMWXCE-UHFFFAOYSA-N
XLogP3.93
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide (CID 46908965) is 2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide is Cc1nc2ncccc2cc1C(=O)NCc1ccc(-c2ccccc2)nc1.
What is the InChIKey of 2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide?
The InChIKey is PIZLEUHCHMWXCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O/c1-15-19(12-18-8-5-11-23-21(18)26-15)22(27)25-14-16-9-10-20(24-13-16)17-6-3-2-4-7-17/h2-13H,14H2,1H3,(H,25,27).
What are the key properties of 2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide?
2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide has a molecular weight of 354.41 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(6-phenyl-3-pyridinyl)methyl]-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 46908965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).