1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide

C16H17N3O2 — CID 82518505

IUPAC1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(-c2cccc(OC)c2)n(C2CC2)c1=O
InChIInChI=1S/C16H17N3O2/c1-21-12-4-2-3-10(9-12)14-8-7-13(15(17)18)16(20)19(14)11-5-6-11/h2-4,7-9,11H,5-6H2,1H3,(H3,17,18)
InChIKeyWINRIIFDIIWEAM-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.14
Rot. Bonds4

About 1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide

1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide (PubChem CID 82518505) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide.

Molecular Properties

Compound Name1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide
PubChem CID82518505
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(-c2cccc(OC)c2)n(C2CC2)c1=O
InChIInChI=1S/C16H17N3O2/c1-21-12-4-2-3-10(9-12)14-8-7-13(15(17)18)16(20)19(14)11-5-6-11/h2-4,7-9,11H,5-6H2,1H3,(H3,17,18)
InChIKeyWINRIIFDIIWEAM-UHFFFAOYSA-N
XLogP2.14
TPSA81.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclopropyl-2-oxo-6-(4-propan-2-ylphenyl)pyridine-3-carboximidamide
CID 82520398
1-cyclopropyl-6-methyl-2-oxopyridine-3-carboximidamide
CID 82525216
1-cyclohexyl-6-methyl-2-oxopyridine-3-carboximidamide
CID 82524843
2,4-dimethoxybenzenecarboximidamide
CID 4138242
3-acetyl-1-ethyl-6-(3-methoxyphenyl)pyridin-2-one
CID 82518556
6-(3-methoxyphenyl)pyridine-2-carboximidamide;hydrochloride
CID 53485064
1-cyclopropyl-1-[3-(3-methoxyphenyl)phenyl]propan-2-one;ethane;ethanimidamide
CID 145460869
3-amino-1-cyclopropyl-6-(4-methoxy-3-methylphenyl)pyridin-2-one
CID 82467193
4-methoxy-2-(oxan-4-yloxy)benzenecarboximidamide
CID 81302635
2-cyclohexylsulfanyl-4-methoxybenzenecarboximidamide
CID 81302879
3-(aminomethyl)-6-(3-methoxyphenyl)-1-methylpyridin-2-one
CID 82189410
4-methoxy-2-[(1-methylpiperidin-2-yl)methoxy]benzenecarboximidamide
CID 81302746

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide?
The IUPAC name of 1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide (CID 82518505) is 1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide.
What is the SMILES notation for 1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide?
The canonical SMILES for 1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(-c2cccc(OC)c2)n(C2CC2)c1=O.
What is the InChIKey of 1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide?
The InChIKey is WINRIIFDIIWEAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-21-12-4-2-3-10(9-12)14-8-7-13(15(17)18)16(20)19(14)11-5-6-11/h2-4,7-9,11H,5-6H2,1H3,(H3,17,18).
What are the key properties of 1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide?
1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide has a molecular weight of 283.33 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-6-(3-methoxyphenyl)-2-oxopyridine-3-carboximidamide is sourced from PubChem (CID 82518505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).