5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole

C13H14N2 — CID 116869108

IUPAC5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole
SMILESCn1nccc1-c1ccc2c(c1)CCC2
InChIInChI=1S/C13H14N2/c1-15-13(7-8-14-15)12-6-5-10-3-2-4-11(10)9-12/h5-9H,2-4H2,1H3
InChIKeyREBYMASPAQXNFS-UHFFFAOYSA-N
MW198.27 g/mol
LogP2.58
Rot. Bonds1

About 5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole

5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole (PubChem CID 116869108) has the molecular formula C13H14N2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole.

Molecular Properties

Compound Name5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole
PubChem CID116869108
Molecular FormulaC13H14N2
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC Name5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole
SMILESCn1nccc1-c1ccc2c(c1)CCC2
InChIInChI=1S/C13H14N2/c1-15-13(7-8-14-15)12-6-5-10-3-2-4-11(10)9-12/h5-9H,2-4H2,1H3
InChIKeyREBYMASPAQXNFS-UHFFFAOYSA-N
XLogP2.58
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole 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-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrazole
CID 116869099
2'-methyl-6-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
CID 58466946
5-(3,4-dichlorophenyl)-1-methylpyrazole
CID 71232464
4-(2-methylpyrazol-3-yl)benzene-1,2-diamine
CID 91618945
5-benzylsulfanyl-2,3-dihydro-1H-indene;1-methyl-5-[3-(trifluoromethyl)phenyl]pyrazole
CID 142423988
1-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazole
CID 91528973
5-(4-chlorophenyl)-1-methylpyrazole
CID 12581093
5-(4-methylphenyl)-2,3-dihydro-1H-indene
CID 59217485
N-(2,3-dihydro-1H-inden-5-ylmethyl)-2-(2-methylpyrazol-3-yl)ethanamine
CID 104694435
5-(3-fluoro-4-methoxyphenyl)-1-methylpyrazole
CID 116869104
1-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrrole-2-carboxylic acid
CID 82088702
3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole
CID 116868892

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole?
The IUPAC name of 5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole (CID 116869108) is 5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole.
What is the SMILES notation for 5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole?
The canonical SMILES for 5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole is Cn1nccc1-c1ccc2c(c1)CCC2.
What is the InChIKey of 5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole?
The InChIKey is REBYMASPAQXNFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2/c1-15-13(7-8-14-15)12-6-5-10-3-2-4-11(10)9-12/h5-9H,2-4H2,1H3.
What are the key properties of 5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole?
5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole has a molecular weight of 198.27 g/mol, XLogP of 2.58, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dihydro-1H-inden-5-yl)-1-methylpyrazole is sourced from PubChem (CID 116869108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).