2,3-dimethyl-3,3a-dihydroindazole

C9H12N2 — CID 167182553

IUPAC2,3-dimethyl-3,3a-dihydroindazole
SMILESCC1C2C=CC=CC2=NN1C
InChIInChI=1S/C9H12N2/c1-7-8-5-3-4-6-9(8)10-11(7)2/h3-8H,1-2H3
InChIKeyPWLKWIFOPACBNB-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.42
Rot. Bonds

About 2,3-dimethyl-3,3a-dihydroindazole

2,3-dimethyl-3,3a-dihydroindazole (PubChem CID 167182553) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 2,3-dimethyl-3,3a-dihydroindazole.

Molecular Properties

Compound Name2,3-dimethyl-3,3a-dihydroindazole
PubChem CID167182553
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name2,3-dimethyl-3,3a-dihydroindazole
SMILESCC1C2C=CC=CC2=NN1C
InChIInChI=1S/C9H12N2/c1-7-8-5-3-4-6-9(8)10-11(7)2/h3-8H,1-2H3
InChIKeyPWLKWIFOPACBNB-UHFFFAOYSA-N
XLogP1.42
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,3-dimethyl-3,3a-dihydroindazole 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

9-methyl-8a,9a-dihydrocarbazole
CID 121338970
9,10-dimethyl-1,8a,9,9a-tetrahydroanthracene
CID 145156109
2,4-dimethyl-6-(3-methyl-3aH-benzotriazol-2-yl)phenol
CID 73430782
4-methoxy-1-methyl-8aH-quinoline
CID 163176137
N-(3,4,6,7,7a,7b-hexahydro-2H-indolo[2,3-a]quinolizin-1-ylidene)hydroxylamine
CID 142636548
5-(4-methylpiperazin-1-yl)-4a,8a-dihydroquinazolino[2,3-a]phthalazin-8-one
CID 150009461
2-ethyl-4,4a-dihydroquinazoline
CID 138718106
3-(3-oxo-3aH-indazol-2-yl)propanoic acid
CID 78198745
4-methyl-2,4-dihydrocyclohepta[d]triazole
CID 143207550
8,11-dimethyl-4a,8,11,11a-tetrahydrocyclohepta[b]naphthalen-5-one
CID 143703315
2-methyl-8aH-pyrazolo[1,5-a]benzimidazole
CID 91725797
2-methyl-3-prop-2-enyl-2,4a-dihydroquinazolin-4-one
CID 23823107

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-3,3a-dihydroindazole?
The IUPAC name of 2,3-dimethyl-3,3a-dihydroindazole (CID 167182553) is 2,3-dimethyl-3,3a-dihydroindazole.
What is the SMILES notation for 2,3-dimethyl-3,3a-dihydroindazole?
The canonical SMILES for 2,3-dimethyl-3,3a-dihydroindazole is CC1C2C=CC=CC2=NN1C.
What is the InChIKey of 2,3-dimethyl-3,3a-dihydroindazole?
The InChIKey is PWLKWIFOPACBNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-7-8-5-3-4-6-9(8)10-11(7)2/h3-8H,1-2H3.
What are the key properties of 2,3-dimethyl-3,3a-dihydroindazole?
2,3-dimethyl-3,3a-dihydroindazole has a molecular weight of 148.21 g/mol, XLogP of 1.42, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-3,3a-dihydroindazole is sourced from PubChem (CID 167182553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).