1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide

C10H13N3O — CID 82525216

IUPAC1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(C)n(C2CC2)c1=O
InChIInChI=1S/C10H13N3O/c1-6-2-5-8(9(11)12)10(14)13(6)7-3-4-7/h2,5,7H,3-4H2,1H3,(H3,11,12)
InChIKeyOBMRZPJMKWJKPR-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.78
Rot. Bonds2

About 1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide

1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide (PubChem CID 82525216) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide.

Molecular Properties

Compound Name1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide
PubChem CID82525216
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(C)n(C2CC2)c1=O
InChIInChI=1S/C10H13N3O/c1-6-2-5-8(9(11)12)10(14)13(6)7-3-4-7/h2,5,7H,3-4H2,1H3,(H3,11,12)
InChIKeyOBMRZPJMKWJKPR-UHFFFAOYSA-N
XLogP0.78
TPSA71.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1-cyclohexyl-6-methyl-2-oxopyridine-3-carboximidamide
CID 82524843
3-acetyl-1-cyclopropyl-6-methylpyridin-2-one
CID 82525165
1-cyclopropyl-2-oxo-6-(4-propan-2-ylphenyl)pyridine-3-carboximidamide
CID 82520398
1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide
CID 82518505
3-acetyl-6-methyl-1-piperidin-4-ylpyridin-2-one
CID 82144520
3-(aminomethyl)-1-cyclopropyl-6-methylpyridin-2-one
CID 82188971
1-cyclopropyl-2-oxo-6-propan-2-ylpyridine-3-carbothioamide
CID 82524390
3-(aminomethyl)-1-cyclobutyl-6-methylpyridin-2-one
CID 105446451
2-oxo-6-propan-2-yl-1-propylpyridine-3-carboximidamide
CID 82524435
1-cyclopropylaziridine-2,3-dione
CID 154037475
3-(2-amino-1,3-thiazol-4-yl)-1-cyclopropyl-6-methylpyridin-2-one
CID 82525174
1-cyclopropyl-6-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid
CID 82520836

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide?
The IUPAC name of 1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide (CID 82525216) is 1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide.
What is the SMILES notation for 1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide?
The canonical SMILES for 1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(C)n(C2CC2)c1=O.
What is the InChIKey of 1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide?
The InChIKey is OBMRZPJMKWJKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-6-2-5-8(9(11)12)10(14)13(6)7-3-4-7/h2,5,7H,3-4H2,1H3,(H3,11,12).
What are the key properties of 1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide?
1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide has a molecular weight of 191.23 g/mol, XLogP of 0.78, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide is sourced from PubChem (CID 82525216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).