3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one

C9H10N4O — CID 146640593

IUPAC3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one
SMILESCn1cc(-c2cn[nH]c2)cc(N)c1=O
InChIInChI=1S/C9H10N4O/c1-13-5-6(2-8(10)9(13)14)7-3-11-12-4-7/h2-5H,10H2,1H3,(H,11,12)
InChIKeyFDFRKAZSKAKTDW-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.36
Rot. Bonds1

About 3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one

3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one (PubChem CID 146640593) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one
PubChem CID146640593
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one
SMILESCn1cc(-c2cn[nH]c2)cc(N)c1=O
InChIInChI=1S/C9H10N4O/c1-13-5-6(2-8(10)9(13)14)7-3-11-12-4-7/h2-5H,10H2,1H3,(H,11,12)
InChIKeyFDFRKAZSKAKTDW-UHFFFAOYSA-N
XLogP0.36
TPSA76.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one?
The IUPAC name of 3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one (CID 146640593) is 3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one?
The canonical SMILES for 3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one is Cn1cc(-c2cn[nH]c2)cc(N)c1=O.
What is the InChIKey of 3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one?
The InChIKey is FDFRKAZSKAKTDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-13-5-6(2-8(10)9(13)14)7-3-11-12-4-7/h2-5H,10H2,1H3,(H,11,12).
What are the key properties of 3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one?
3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one has a molecular weight of 190.21 g/mol, XLogP of 0.36, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-methyl-5-(1H-pyrazol-4-yl)pyridin-2-one is sourced from PubChem (CID 146640593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).