1,2-dihydro-1,7-naphthyridine-5-carboxamide

C9H9N3O — CID 170522849

IUPAC1,2-dihydro-1,7-naphthyridine-5-carboxamide
SMILESNC(=O)c1cncc2c1C=CCN2
InChIInChI=1S/C9H9N3O/c10-9(13)7-4-11-5-8-6(7)2-1-3-12-8/h1-2,4-5,12H,3H2,(H2,10,13)
InChIKeyMDPOWVKPEXOEMU-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.62
Rot. Bonds1

About 1,2-dihydro-1,7-naphthyridine-5-carboxamide

1,2-dihydro-1,7-naphthyridine-5-carboxamide (PubChem CID 170522849) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 1,2-dihydro-1,7-naphthyridine-5-carboxamide.

Molecular Properties

Compound Name1,2-dihydro-1,7-naphthyridine-5-carboxamide
PubChem CID170522849
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name1,2-dihydro-1,7-naphthyridine-5-carboxamide
SMILESNC(=O)c1cncc2c1C=CCN2
InChIInChI=1S/C9H9N3O/c10-9(13)7-4-11-5-8-6(7)2-1-3-12-8/h1-2,4-5,12H,3H2,(H2,10,13)
InChIKeyMDPOWVKPEXOEMU-UHFFFAOYSA-N
XLogP0.62
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2-dihydro-1,7-naphthyridine-5-carboxamide?
The IUPAC name of 1,2-dihydro-1,7-naphthyridine-5-carboxamide (CID 170522849) is 1,2-dihydro-1,7-naphthyridine-5-carboxamide.
What is the SMILES notation for 1,2-dihydro-1,7-naphthyridine-5-carboxamide?
The canonical SMILES for 1,2-dihydro-1,7-naphthyridine-5-carboxamide is NC(=O)c1cncc2c1C=CCN2.
What is the InChIKey of 1,2-dihydro-1,7-naphthyridine-5-carboxamide?
The InChIKey is MDPOWVKPEXOEMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c10-9(13)7-4-11-5-8-6(7)2-1-3-12-8/h1-2,4-5,12H,3H2,(H2,10,13).
What are the key properties of 1,2-dihydro-1,7-naphthyridine-5-carboxamide?
1,2-dihydro-1,7-naphthyridine-5-carboxamide has a molecular weight of 175.19 g/mol, XLogP of 0.62, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dihydro-1,7-naphthyridine-5-carboxamide is sourced from PubChem (CID 170522849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).