3-methyl-2H-pyridine-1-carboxamide

C7H10N2O — CID 18598307

IUPAC3-methyl-2H-pyridine-1-carboxamide
SMILESCC1=CC=CN(C(N)=O)C1
InChIInChI=1S/C7H10N2O/c1-6-3-2-4-9(5-6)7(8)10/h2-4H,5H2,1H3,(H2,8,10)
InChIKeyUSQLNIGLJOCWRU-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.84
Rot. Bonds

About 3-methyl-2H-pyridine-1-carboxamide

3-methyl-2H-pyridine-1-carboxamide (PubChem CID 18598307) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 3-methyl-2H-pyridine-1-carboxamide.

Molecular Properties

Compound Name3-methyl-2H-pyridine-1-carboxamide
PubChem CID18598307
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name3-methyl-2H-pyridine-1-carboxamide
SMILESCC1=CC=CN(C(N)=O)C1
InChIInChI=1S/C7H10N2O/c1-6-3-2-4-9(5-6)7(8)10/h2-4H,5H2,1H3,(H2,8,10)
InChIKeyUSQLNIGLJOCWRU-UHFFFAOYSA-N
XLogP0.84
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2H-pyridine-1-carboxamide?
The IUPAC name of 3-methyl-2H-pyridine-1-carboxamide (CID 18598307) is 3-methyl-2H-pyridine-1-carboxamide.
What is the SMILES notation for 3-methyl-2H-pyridine-1-carboxamide?
The canonical SMILES for 3-methyl-2H-pyridine-1-carboxamide is CC1=CC=CN(C(N)=O)C1.
What is the InChIKey of 3-methyl-2H-pyridine-1-carboxamide?
The InChIKey is USQLNIGLJOCWRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-6-3-2-4-9(5-6)7(8)10/h2-4H,5H2,1H3,(H2,8,10).
What are the key properties of 3-methyl-2H-pyridine-1-carboxamide?
3-methyl-2H-pyridine-1-carboxamide has a molecular weight of 138.17 g/mol, XLogP of 0.84, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2H-pyridine-1-carboxamide is sourced from PubChem (CID 18598307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).