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

C15H13N5O — CID 86305715

IUPAC6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESN#Cc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1
InChIInChI=1S/C15H13N5O/c16-6-10-4-12(8-18-7-10)13-5-11-2-1-3-20(15(17)21)14(11)19-9-13/h4-5,7-9H,1-3H2,(H2,17,21)
InChIKeyZGRRGHZCEYDQOE-UHFFFAOYSA-N
MW279.30 g/mol
LogP1.85
Rot. Bonds1

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

6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 86305715) has the molecular formula C15H13N5O and a molecular weight of 279.30 g/mol. Its IUPAC name is 6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound Name6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID86305715
Molecular FormulaC15H13N5O
Molecular Weight279.30 g/mol
Exact Mass279.11
IUPAC Name6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESN#Cc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1
InChIInChI=1S/C15H13N5O/c16-6-10-4-12(8-18-7-10)13-5-11-2-1-3-20(15(17)21)14(11)19-9-13/h4-5,7-9H,1-3H2,(H2,17,21)
InChIKeyZGRRGHZCEYDQOE-UHFFFAOYSA-N
XLogP1.85
TPSA95.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of 6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 86305715) is 6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for 6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for 6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is N#Cc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1.
What is the InChIKey of 6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is ZGRRGHZCEYDQOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O/c16-6-10-4-12(8-18-7-10)13-5-11-2-1-3-20(15(17)21)14(11)19-9-13/h4-5,7-9H,1-3H2,(H2,17,21).
What are the key properties of 6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 279.30 g/mol, XLogP of 1.85, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-cyano-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 86305715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).