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

C15H16N2O — CID 114972424

IUPAC2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone
SMILESCCn1nccc1C(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C15H16N2O/c1-2-17-14(8-9-16-17)15(18)13-7-6-11-4-3-5-12(11)10-13/h6-10H,2-5H2,1H3
InChIKeyOPGSGFLVCWNPKY-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.62
Rot. Bonds3

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

2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone (PubChem CID 114972424) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone
PubChem CID114972424
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone
SMILESCCn1nccc1C(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C15H16N2O/c1-2-17-14(8-9-16-17)15(18)13-7-6-11-4-3-5-12(11)10-13/h6-10H,2-5H2,1H3
InChIKeyOPGSGFLVCWNPKY-UHFFFAOYSA-N
XLogP2.62
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone 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

1,3-dihydro-2-benzofuran-5-yl-(2-ethylpyrazol-3-yl)methanone
CID 114972403
(2-ethylpyrazol-3-yl)-(5-methylfuran-3-yl)methanone
CID 114972432
[2-(aminomethyl)-4-pyridinyl]-(2-ethylpyrazol-3-yl)methanone
CID 116601777
[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(2,3-dihydro-1H-inden-5-yl)methanone
CID 115815185
(3,5-dibromophenyl)-(2,3-dihydro-1H-inden-5-yl)methanone
CID 107979596
(E)-3-[3-(2,3-dihydro-1H-inden-5-yloxymethyl)-4-methoxyphenyl]-1-(2-ethylpyrazol-3-yl)prop-2-en-1-one
CID 19553154
(2-ethylpyrazol-3-yl)-(1-methylcyclopentyl)methanone
CID 114972401
2,2-dimethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-one
CID 62679922
2,3-dihydro-1H-inden-5-yl-(4-fluoro-2,6-dimethylphenyl)methanone
CID 106877016
(2-ethylpyrazol-3-yl)-(2-fluoro-5-methylphenyl)methanone
CID 114972492
5-(2,3-dihydro-1H-indene-5-carbonyl)-1,3-dimethylpyrimidine-2,4-dione
CID 43339138
(4-chloro-2-fluorophenyl)-(2-ethylpyrazol-3-yl)methanone
CID 63976130

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone?
The IUPAC name of 2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone (CID 114972424) is 2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone?
The canonical SMILES for 2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone is CCn1nccc1C(=O)c1ccc2c(c1)CCC2.
What is the InChIKey of 2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone?
The InChIKey is OPGSGFLVCWNPKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-2-17-14(8-9-16-17)15(18)13-7-6-11-4-3-5-12(11)10-13/h6-10H,2-5H2,1H3.
What are the key properties of 2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone?
2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone has a molecular weight of 240.31 g/mol, XLogP of 2.62, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-5-yl-(2-ethylpyrazol-3-yl)methanone is sourced from PubChem (CID 114972424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).