7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one

C17H15N3O — CID 162528335

IUPAC7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one
SMILESCc1ccc(-c2ccc3cnn(C)c3c2)c2c1C(=O)NC2
InChIInChI=1S/C17H15N3O/c1-10-3-6-13(14-9-18-17(21)16(10)14)11-4-5-12-8-19-20(2)15(12)7-11/h3-8H,9H2,1-2H3,(H,18,21)
InChIKeyOYLZNSBAYQBJFR-UHFFFAOYSA-N
MW277.33 g/mol
LogP2.79
Rot. Bonds1

About 7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one

7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one (PubChem CID 162528335) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one.

Molecular Properties

Compound Name7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one
PubChem CID162528335
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one
SMILESCc1ccc(-c2ccc3cnn(C)c3c2)c2c1C(=O)NC2
InChIInChI=1S/C17H15N3O/c1-10-3-6-13(14-9-18-17(21)16(10)14)11-4-5-12-8-19-20(2)15(12)7-11/h3-8H,9H2,1-2H3,(H,18,21)
InChIKeyOYLZNSBAYQBJFR-UHFFFAOYSA-N
XLogP2.79
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-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

7-methoxy-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one
CID 162529381
2-[[4-amino-7-(1-methylindazol-6-yl)-3-oxo-1H-isoindol-2-yl]methyl]prop-2-enenitrile
CID 162529277
4-(1-methylindazol-6-yl)-2-[[(2R)-oxiran-2-yl]methyl]-3H-isoindol-1-one
CID 162528916
7-amino-4-(1-methylindazol-6-yl)-2-[(E)-3-phenylprop-2-enyl]-3H-isoindol-1-one
CID 162528778
(E)-2-[[4-amino-7-(1-methylindazol-6-yl)-3-oxo-1H-isoindol-2-yl]methyl]but-2-enenitrile
CID 162529123
N-[2-(2-cyanoprop-2-enyl)-7-(1-methylindazol-6-yl)-3-oxo-1H-isoindol-4-yl]acetamide
CID 162528297
7-(1-methylindazol-6-yl)isoquinoline
CID 166387565
7-amino-4-(4-methoxyphenyl)-2,3-dihydroisoindol-1-one
CID 122639239
7-(methylamino)-4-(1-methylindazol-6-yl)-2-[2-(1,3-thiazol-2-yl)prop-2-enyl]-3H-isoindol-1-one
CID 162529500
(Z)-2-[[4-amino-7-(1-methylindazol-6-yl)-3-oxo-1H-isoindol-2-yl]methyl]-3-(1-methylpyrazol-4-yl)prop-2-enenitrile
CID 162529051
5-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-3,4-dihydro-2H-isoquinolin-1-one
CID 118664662
4-methyl-2-(1-methylindazol-6-yl)-1,3-thiazole
CID 166386367

Frequently Asked Questions

What is the IUPAC name of 7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one?
The IUPAC name of 7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one (CID 162528335) is 7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one.
What is the SMILES notation for 7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one?
The canonical SMILES for 7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one is Cc1ccc(-c2ccc3cnn(C)c3c2)c2c1C(=O)NC2.
What is the InChIKey of 7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one?
The InChIKey is OYLZNSBAYQBJFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-10-3-6-13(14-9-18-17(21)16(10)14)11-4-5-12-8-19-20(2)15(12)7-11/h3-8H,9H2,1-2H3,(H,18,21).
What are the key properties of 7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one?
7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one has a molecular weight of 277.33 g/mol, XLogP of 2.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-4-(1-methylindazol-6-yl)-2,3-dihydroisoindol-1-one is sourced from PubChem (CID 162528335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).