hydron;N-(1,6-naphthyridin-3-yl)formamide

C9H8N3O+ — CID 174959508

IUPAChydron;N-(1,6-naphthyridin-3-yl)formamide
SMILESO=CNc1cnc2ccncc2c1.[H+]
InChIInChI=1S/C9H7N3O/c13-6-12-8-3-7-4-10-2-1-9(7)11-5-8/h1-6H,(H,12,13)/p+1
InChIKeyBYOVIMVOUZHOLW-UHFFFAOYSA-O
MW174.18 g/mol
LogP1.31
Rot. Bonds2

About hydron;N-(1,6-naphthyridin-3-yl)formamide

hydron;N-(1,6-naphthyridin-3-yl)formamide (PubChem CID 174959508) has the molecular formula C9H8N3O+ and a molecular weight of 174.18 g/mol. Its IUPAC name is hydron;N-(1,6-naphthyridin-3-yl)formamide.

Molecular Properties

Compound Namehydron;N-(1,6-naphthyridin-3-yl)formamide
PubChem CID174959508
Molecular FormulaC9H8N3O+
Molecular Weight174.18 g/mol
Exact Mass174.07
IUPAC Namehydron;N-(1,6-naphthyridin-3-yl)formamide
SMILESO=CNc1cnc2ccncc2c1.[H+]
InChIInChI=1S/C9H7N3O/c13-6-12-8-3-7-4-10-2-1-9(7)11-5-8/h1-6H,(H,12,13)/p+1
InChIKeyBYOVIMVOUZHOLW-UHFFFAOYSA-O
XLogP1.31
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.18
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of hydron;N-(1,6-naphthyridin-3-yl)formamide?
The IUPAC name of hydron;N-(1,6-naphthyridin-3-yl)formamide (CID 174959508) is hydron;N-(1,6-naphthyridin-3-yl)formamide.
What is the SMILES notation for hydron;N-(1,6-naphthyridin-3-yl)formamide?
The canonical SMILES for hydron;N-(1,6-naphthyridin-3-yl)formamide is O=CNc1cnc2ccncc2c1.[H+].
What is the InChIKey of hydron;N-(1,6-naphthyridin-3-yl)formamide?
The InChIKey is BYOVIMVOUZHOLW-UHFFFAOYSA-O. The full InChI is InChI=1S/C9H7N3O/c13-6-12-8-3-7-4-10-2-1-9(7)11-5-8/h1-6H,(H,12,13)/p+1.
What are the key properties of hydron;N-(1,6-naphthyridin-3-yl)formamide?
hydron;N-(1,6-naphthyridin-3-yl)formamide has a molecular weight of 174.18 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;N-(1,6-naphthyridin-3-yl)formamide is sourced from PubChem (CID 174959508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).