2H-pyridine-1-carboxamide

C6H8N2O — CID 18598302

IUPAC2H-pyridine-1-carboxamide
SMILESC1C=CC=CN1C(=O)N
InChIInChI=1S/C6H8N2O/c7-6(9)8-4-2-1-3-5-8/h1-4H,5H2,(H2,7,9)
InChIKeySQCOEUUTSVPTAE-UHFFFAOYSA-N
MW124.14 g/mol
LogP-0.10
Rot. Bonds

About 2H-pyridine-1-carboxamide

2H-pyridine-1-carboxamide (PubChem CID 18598302) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is 2H-pyridine-1-carboxamide.

Molecular Properties

Compound Name2H-pyridine-1-carboxamide
PubChem CID18598302
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC Name2H-pyridine-1-carboxamide
SMILESC1C=CC=CN1C(=O)N
InChIInChI=1S/C6H8N2O/c7-6(9)8-4-2-1-3-5-8/h1-4H,5H2,(H2,7,9)
InChIKeySQCOEUUTSVPTAE-UHFFFAOYSA-N
XLogP-0.10
TPSA46.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity172

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1H-Azepine-1-carboxamide
CID 21247429
N-methylcarbamoylpyridine
CID 129798221
3-fluoro-2H-pyridine-1-carboxamide
CID 91070082
N,N-dimethyl-2H-pyridine-1-carboxamide
CID 17770845
3-methyl-2H-pyridine-1-carboxamide
CID 18598307
2-methyl-2H-pyridine-1-carboxamide
CID 18598309
1,2-Dihydropyridin-4-ylurea
CID 20144166
6-methyl-2H-pyridine-1-carboxamide
CID 20236587
3-chloro-2H-pyridine-1-carboxamide
CID 20278815
4-methyl-2H-pyridine-1-carboxamide
CID 20438361
N-cyano-2H-pyridine-1-carboxamide
CID 22149205
bis(2H-pyridin-1-yl)methanone
CID 54498373

Frequently Asked Questions

What is the IUPAC name of 2H-pyridine-1-carboxamide?
The IUPAC name of 2H-pyridine-1-carboxamide (CID 18598302) is 2H-pyridine-1-carboxamide.
What is the SMILES notation for 2H-pyridine-1-carboxamide?
The canonical SMILES for 2H-pyridine-1-carboxamide is C1C=CC=CN1C(=O)N.
What is the InChIKey of 2H-pyridine-1-carboxamide?
The InChIKey is SQCOEUUTSVPTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c7-6(9)8-4-2-1-3-5-8/h1-4H,5H2,(H2,7,9).
What are the key properties of 2H-pyridine-1-carboxamide?
2H-pyridine-1-carboxamide has a molecular weight of 124.14 g/mol, XLogP of -0.10, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-pyridine-1-carboxamide is sourced from PubChem (CID 18598302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).