2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol

C16H14N2O — CID 15637036

IUPAC2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol
SMILESOC1C(c2ccccc2)=NN2c3ccccc3CC12
InChIInChI=1S/C16H14N2O/c19-16-14-10-12-8-4-5-9-13(12)18(14)17-15(16)11-6-2-1-3-7-11/h1-9,14,16,19H,10H2
InChIKeyRHYYHBLPXVMLMS-UHFFFAOYSA-N
MW250.30 g/mol
LogP2.20
Rot. Bonds1

About 2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol

2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol (PubChem CID 15637036) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol.

Molecular Properties

Compound Name2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol
PubChem CID15637036
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol
SMILESOC1C(c2ccccc2)=NN2c3ccccc3CC12
InChIInChI=1S/C16H14N2O/c19-16-14-10-12-8-4-5-9-13(12)18(14)17-15(16)11-6-2-1-3-7-11/h1-9,14,16,19H,10H2
InChIKeyRHYYHBLPXVMLMS-UHFFFAOYSA-N
XLogP2.20
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3aS,8bR)-3-(4-chlorophenyl)-1-phenyl-4,8b-dihydro-3aH-indeno[2,1-c]pyrazole
CID 7113051
(3aS,6aR)-1-(4-chlorophenyl)-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrazole
CID 95987197
(3aR,6aR)-1-(4-chlorophenyl)-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrazole
CID 95987199
1-methyl-3-phenyl-3a,4,5,6,7,7a-hexahydroindazole
CID 13153343
2-[(3S)-2,5-diphenyl-3,4-dihydropyrazol-3-yl]propan-2-ol
CID 7570848
2-methyl-1-(4-phenylphenyl)-2,3-dihydroindole
CID 20685477
1-methyl-2,3-dihydroindol-2-ol
CID 70661566
methyl 3a,4-dihydro-3H-pyrazolo[1,5-a]indole-2-carboxylate
CID 12727543
(3aS,8bS)-4-ethyl-3-(4-methylphenyl)-1-phenyl-3a,8b-dihydropyrazolo[3,4-b]indole
CID 14661023
2-(2-hydroxy-2,3-dihydroindol-1-yl)acetic acid
CID 133188486
2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indol-3-amine
CID 82411355
2-iodo-1-methyl-2,3-dihydroindole
CID 143057864

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol?
The IUPAC name of 2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol (CID 15637036) is 2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol.
What is the SMILES notation for 2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol?
The canonical SMILES for 2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol is OC1C(c2ccccc2)=NN2c3ccccc3CC12.
What is the InChIKey of 2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol?
The InChIKey is RHYYHBLPXVMLMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c19-16-14-10-12-8-4-5-9-13(12)18(14)17-15(16)11-6-2-1-3-7-11/h1-9,14,16,19H,10H2.
What are the key properties of 2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol?
2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol has a molecular weight of 250.30 g/mol, XLogP of 2.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3a,4-dihydro-3H-pyrazolo[1,5-a]indol-3-ol is sourced from PubChem (CID 15637036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).