4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide

C14H13ClN4O — CID 118911016

IUPAC4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide
SMILESNC(=O)c1cc(-c2ccc(Cl)cn2)c2c(n1)CNCC2
InChIInChI=1S/C14H13ClN4O/c15-8-1-2-11(18-6-8)10-5-12(14(16)20)19-13-7-17-4-3-9(10)13/h1-2,5-6,17H,3-4,7H2,(H2,16,20)
InChIKeyGAHHIHGSSHWHEJ-UHFFFAOYSA-N
MW288.74 g/mol
LogP1.54
Rot. Bonds2

About 4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide

4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide (PubChem CID 118911016) has the molecular formula C14H13ClN4O and a molecular weight of 288.74 g/mol. Its IUPAC name is 4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide.

Molecular Properties

Compound Name4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide
PubChem CID118911016
Molecular FormulaC14H13ClN4O
Molecular Weight288.74 g/mol
Exact Mass288.08
IUPAC Name4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide
SMILESNC(=O)c1cc(-c2ccc(Cl)cn2)c2c(n1)CNCC2
InChIInChI=1S/C14H13ClN4O/c15-8-1-2-11(18-6-8)10-5-12(14(16)20)19-13-7-17-4-3-9(10)13/h1-2,5-6,17H,3-4,7H2,(H2,16,20)
InChIKeyGAHHIHGSSHWHEJ-UHFFFAOYSA-N
XLogP1.54
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.74
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-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 4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide?
The IUPAC name of 4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide (CID 118911016) is 4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide.
What is the SMILES notation for 4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide?
The canonical SMILES for 4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide is NC(=O)c1cc(-c2ccc(Cl)cn2)c2c(n1)CNCC2.
What is the InChIKey of 4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide?
The InChIKey is GAHHIHGSSHWHEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN4O/c15-8-1-2-11(18-6-8)10-5-12(14(16)20)19-13-7-17-4-3-9(10)13/h1-2,5-6,17H,3-4,7H2,(H2,16,20).
What are the key properties of 4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide?
4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide has a molecular weight of 288.74 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-chloro-2-pyridinyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide is sourced from PubChem (CID 118911016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).