6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C15H12ClN5O — CID 86305323

IUPAC6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESN#Cc1c(Cl)cncc1-c1cnc2c(c1)CCCN2C(N)=O
InChIInChI=1S/C15H12ClN5O/c16-13-8-19-7-12(11(13)5-17)10-4-9-2-1-3-21(15(18)22)14(9)20-6-10/h4,6-8H,1-3H2,(H2,18,22)
InChIKeyJJTARXQGAQJOMD-UHFFFAOYSA-N
MW313.75 g/mol
LogP2.50
Rot. Bonds1

About 6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 86305323) has the molecular formula C15H12ClN5O and a molecular weight of 313.75 g/mol. Its IUPAC name is 6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound Name6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID86305323
Molecular FormulaC15H12ClN5O
Molecular Weight313.75 g/mol
Exact Mass313.07
IUPAC Name6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESN#Cc1c(Cl)cncc1-c1cnc2c(c1)CCCN2C(N)=O
InChIInChI=1S/C15H12ClN5O/c16-13-8-19-7-12(11(13)5-17)10-4-9-2-1-3-21(15(18)22)14(9)20-6-10/h4,6-8H,1-3H2,(H2,18,22)
InChIKeyJJTARXQGAQJOMD-UHFFFAOYSA-N
XLogP2.50
TPSA95.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.75
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of 6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 86305323) is 6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for 6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for 6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is N#Cc1c(Cl)cncc1-c1cnc2c(c1)CCCN2C(N)=O.
What is the InChIKey of 6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is JJTARXQGAQJOMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN5O/c16-13-8-19-7-12(11(13)5-17)10-4-9-2-1-3-21(15(18)22)14(9)20-6-10/h4,6-8H,1-3H2,(H2,18,22).
What are the key properties of 6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 313.75 g/mol, XLogP of 2.50, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-chloro-4-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 86305323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).