1,7-naphthyridine-3,6-dicarboxamide

C10H8N4O2 — CID 90953080

IUPAC1,7-naphthyridine-3,6-dicarboxamide
SMILESNC(=O)c1cnc2cnc(C(N)=O)cc2c1
InChIInChI=1S/C10H8N4O2/c11-9(15)6-1-5-2-7(10(12)16)14-4-8(5)13-3-6/h1-4H,(H2,11,15)(H2,12,16)
InChIKeyQHCJPEXXZIESQQ-UHFFFAOYSA-N
MW216.20 g/mol
LogP-0.17
Rot. Bonds2

About 1,7-naphthyridine-3,6-dicarboxamide

1,7-naphthyridine-3,6-dicarboxamide (PubChem CID 90953080) has the molecular formula C10H8N4O2 and a molecular weight of 216.20 g/mol. Its IUPAC name is 1,7-naphthyridine-3,6-dicarboxamide.

Molecular Properties

Compound Name1,7-naphthyridine-3,6-dicarboxamide
PubChem CID90953080
Molecular FormulaC10H8N4O2
Molecular Weight216.20 g/mol
Exact Mass216.06
IUPAC Name1,7-naphthyridine-3,6-dicarboxamide
SMILESNC(=O)c1cnc2cnc(C(N)=O)cc2c1
InChIInChI=1S/C10H8N4O2/c11-9(15)6-1-5-2-7(10(12)16)14-4-8(5)13-3-6/h1-4H,(H2,11,15)(H2,12,16)
InChIKeyQHCJPEXXZIESQQ-UHFFFAOYSA-N
XLogP-0.17
TPSA111.96 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.20
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,7-naphthyridine-3,6-dicarboxamide?
The IUPAC name of 1,7-naphthyridine-3,6-dicarboxamide (CID 90953080) is 1,7-naphthyridine-3,6-dicarboxamide.
What is the SMILES notation for 1,7-naphthyridine-3,6-dicarboxamide?
The canonical SMILES for 1,7-naphthyridine-3,6-dicarboxamide is NC(=O)c1cnc2cnc(C(N)=O)cc2c1.
What is the InChIKey of 1,7-naphthyridine-3,6-dicarboxamide?
The InChIKey is QHCJPEXXZIESQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O2/c11-9(15)6-1-5-2-7(10(12)16)14-4-8(5)13-3-6/h1-4H,(H2,11,15)(H2,12,16).
What are the key properties of 1,7-naphthyridine-3,6-dicarboxamide?
1,7-naphthyridine-3,6-dicarboxamide has a molecular weight of 216.20 g/mol, XLogP of -0.17, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,7-naphthyridine-3,6-dicarboxamide is sourced from PubChem (CID 90953080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).