1-methyl-4H-pyridine-2-carboxamide

C7H10N2O — CID 45084059

IUPAC1-methyl-4H-pyridine-2-carboxamide
SMILESCN1C=CCC=C1C(N)=O
InChIInChI=1S/C7H10N2O/c1-9-5-3-2-4-6(9)7(8)10/h3-5H,2H2,1H3,(H2,8,10)
InChIKeyGHRDGVBISRVRLV-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.20
Rot. Bonds1

About 1-methyl-4H-pyridine-2-carboxamide

1-methyl-4H-pyridine-2-carboxamide (PubChem CID 45084059) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 1-methyl-4H-pyridine-2-carboxamide.

Molecular Properties

Compound Name1-methyl-4H-pyridine-2-carboxamide
PubChem CID45084059
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name1-methyl-4H-pyridine-2-carboxamide
SMILESCN1C=CCC=C1C(N)=O
InChIInChI=1S/C7H10N2O/c1-9-5-3-2-4-6(9)7(8)10/h3-5H,2H2,1H3,(H2,8,10)
InChIKeyGHRDGVBISRVRLV-UHFFFAOYSA-N
XLogP0.20
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4H-pyridine-2-carboxamide?
The IUPAC name of 1-methyl-4H-pyridine-2-carboxamide (CID 45084059) is 1-methyl-4H-pyridine-2-carboxamide.
What is the SMILES notation for 1-methyl-4H-pyridine-2-carboxamide?
The canonical SMILES for 1-methyl-4H-pyridine-2-carboxamide is CN1C=CCC=C1C(N)=O.
What is the InChIKey of 1-methyl-4H-pyridine-2-carboxamide?
The InChIKey is GHRDGVBISRVRLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-9-5-3-2-4-6(9)7(8)10/h3-5H,2H2,1H3,(H2,8,10).
What are the key properties of 1-methyl-4H-pyridine-2-carboxamide?
1-methyl-4H-pyridine-2-carboxamide has a molecular weight of 138.17 g/mol, XLogP of 0.20, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4H-pyridine-2-carboxamide is sourced from PubChem (CID 45084059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).