2-methyl-2,3-dihydropyridine-5-carboxamide

C7H10N2O — CID 134593923

IUPAC2-methyl-2,3-dihydropyridine-5-carboxamide
SMILESCC1CC=C(C(N)=O)C=N1
InChIInChI=1S/C7H10N2O/c1-5-2-3-6(4-9-5)7(8)10/h3-5H,2H2,1H3,(H2,8,10)
InChIKeyPMLQVXJNDUTUCI-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.26
Rot. Bonds1

About 2-methyl-2,3-dihydropyridine-5-carboxamide

2-methyl-2,3-dihydropyridine-5-carboxamide (PubChem CID 134593923) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-methyl-2,3-dihydropyridine-5-carboxamide.

Molecular Properties

Compound Name2-methyl-2,3-dihydropyridine-5-carboxamide
PubChem CID134593923
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name2-methyl-2,3-dihydropyridine-5-carboxamide
SMILESCC1CC=C(C(N)=O)C=N1
InChIInChI=1S/C7H10N2O/c1-5-2-3-6(4-9-5)7(8)10/h3-5H,2H2,1H3,(H2,8,10)
InChIKeyPMLQVXJNDUTUCI-UHFFFAOYSA-N
XLogP0.26
TPSA55.45 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 ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2,3-dihydropyridine-5-carboxamide?
The IUPAC name of 2-methyl-2,3-dihydropyridine-5-carboxamide (CID 134593923) is 2-methyl-2,3-dihydropyridine-5-carboxamide.
What is the SMILES notation for 2-methyl-2,3-dihydropyridine-5-carboxamide?
The canonical SMILES for 2-methyl-2,3-dihydropyridine-5-carboxamide is CC1CC=C(C(N)=O)C=N1.
What is the InChIKey of 2-methyl-2,3-dihydropyridine-5-carboxamide?
The InChIKey is PMLQVXJNDUTUCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-5-2-3-6(4-9-5)7(8)10/h3-5H,2H2,1H3,(H2,8,10).
What are the key properties of 2-methyl-2,3-dihydropyridine-5-carboxamide?
2-methyl-2,3-dihydropyridine-5-carboxamide has a molecular weight of 138.17 g/mol, XLogP of 0.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2,3-dihydropyridine-5-carboxamide is sourced from PubChem (CID 134593923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).