5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one

C20H17N3O — CID 175983877

IUPAC5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one
SMILESCn1cc(-c2ccc3cnn(Cc4ccccc4)c3c2)ccc1=O
InChIInChI=1S/C20H17N3O/c1-22-14-18(9-10-20(22)24)16-7-8-17-12-21-23(19(17)11-16)13-15-5-3-2-4-6-15/h2-12,14H,13H2,1H3
InChIKeyHJGPYHRFCQGTJJ-UHFFFAOYSA-N
MW315.38 g/mol
LogP3.45
Rot. Bonds3

About 5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one

5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one (PubChem CID 175983877) has the molecular formula C20H17N3O and a molecular weight of 315.38 g/mol. Its IUPAC name is 5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one.

Molecular Properties

Compound Name5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one
PubChem CID175983877
Molecular FormulaC20H17N3O
Molecular Weight315.38 g/mol
Exact Mass315.14
IUPAC Name5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one
SMILESCn1cc(-c2ccc3cnn(Cc4ccccc4)c3c2)ccc1=O
InChIInChI=1S/C20H17N3O/c1-22-14-18(9-10-20(22)24)16-7-8-17-12-21-23(19(17)11-16)13-15-5-3-2-4-6-15/h2-12,14H,13H2,1H3
InChIKeyHJGPYHRFCQGTJJ-UHFFFAOYSA-N
XLogP3.45
TPSA39.82 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one 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-benzyl-6-fluoroindazole
CID 83414179
N-[4-[[5-(1-benzylindazol-6-yl)-1-methyl-2-oxo-4-pyridinyl]oxy]cyclohexyl]methanesulfonamide
CID 175601465
4-ethoxy-1-methyl-5-[1-(2-phenylethyl)indazol-6-yl]pyridin-2-one
CID 175601464
tert-butyl 4-[[5-(1-benzylindazol-6-yl)-1-methyl-2-oxo-4-pyridinyl]oxy]piperidine-1-carboxylate
CID 175601463
1-benzyl-6-ethenylindazole
CID 58486291
1-benzyl-5,6-dimethoxyindazole
CID 83414174
5-[1-[(3-fluoro-4-methoxyphenyl)methyl]indazol-6-yl]-1-methyl-3-(methylamino)pyridin-2-one
CID 155561660
1-[(3-aminophenyl)methyl]-5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyridin-2-one
CID 140931469
(1S)-1-(1-benzylindazol-6-yl)ethane-1,2-diol
CID 58486137
1-benzyl-5-pyridazin-4-ylindazole
CID 173219391
2-benzyl-5-phenylpyridazin-3-one
CID 71418083
4-(1-benzylindazol-6-yl)-2-methyl-3,4-dihydro-1H-isoquinoline
CID 68996964

Frequently Asked Questions

What is the IUPAC name of 5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one?
The IUPAC name of 5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one (CID 175983877) is 5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one.
What is the SMILES notation for 5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one?
The canonical SMILES for 5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one is Cn1cc(-c2ccc3cnn(Cc4ccccc4)c3c2)ccc1=O.
What is the InChIKey of 5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one?
The InChIKey is HJGPYHRFCQGTJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O/c1-22-14-18(9-10-20(22)24)16-7-8-17-12-21-23(19(17)11-16)13-15-5-3-2-4-6-15/h2-12,14H,13H2,1H3.
What are the key properties of 5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one?
5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one has a molecular weight of 315.38 g/mol, XLogP of 3.45, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-benzylindazol-6-yl)-1-methylpyridin-2-one is sourced from PubChem (CID 175983877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).