3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol

C16H13N3O — CID 137090969

IUPAC3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol
SMILESOc1ccc2c(c1)Cc1c(Nc3ccccc3)n[nH]c1-2
InChIInChI=1S/C16H13N3O/c20-12-6-7-13-10(8-12)9-14-15(13)18-19-16(14)17-11-4-2-1-3-5-11/h1-8,20H,9H2,(H2,17,18,19)
InChIKeyNIBXTYSAYDRHEB-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.43
Rot. Bonds2

About 3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol

3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol (PubChem CID 137090969) has the molecular formula C16H13N3O and a molecular weight of 263.30 g/mol. Its IUPAC name is 3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol.

Molecular Properties

Compound Name3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol
PubChem CID137090969
Molecular FormulaC16H13N3O
Molecular Weight263.30 g/mol
Exact Mass263.11
IUPAC Name3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol
SMILESOc1ccc2c(c1)Cc1c(Nc3ccccc3)n[nH]c1-2
InChIInChI=1S/C16H13N3O/c20-12-6-7-13-10(8-12)9-14-15(13)18-19-16(14)17-11-4-2-1-3-5-11/h1-8,20H,9H2,(H2,17,18,19)
InChIKeyNIBXTYSAYDRHEB-UHFFFAOYSA-N
XLogP3.43
TPSA60.94 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

Jnj-10198409
CID 9797370
3-methyl-N-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 10041745
3-trifluoromethyl-N-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 11569396
N-(3-methoxyphenyl)-1,4-dihydroindeno[2,1-d]pyrazol-3-amine
CID 10084880
3-methoxy-N-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 10359698
(6,7-Dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)-phenyl amine
CID 11525980
(5-Methoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 11536421
(6-Methoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 11565353
(7-Methoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 11608830
N-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydroindeno[2,1-d]pyrazol-3-amine
CID 18445547
4,4'-{3-[(4-Hydroxyphenyl)amino]-1h-Pyrazole-4,5-Diyl}diphenol
CID 135566832
4-{5-[(4-Hydroxyphenyl)amino]-1h-Pyrazol-3-Yl}phenol
CID 135567152

Frequently Asked Questions

What is the IUPAC name of 3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol?
The IUPAC name of 3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol (CID 137090969) is 3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol.
What is the SMILES notation for 3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol?
The canonical SMILES for 3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol is Oc1ccc2c(c1)Cc1c(Nc3ccccc3)n[nH]c1-2.
What is the InChIKey of 3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol?
The InChIKey is NIBXTYSAYDRHEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O/c20-12-6-7-13-10(8-12)9-14-15(13)18-19-16(14)17-11-4-2-1-3-5-11/h1-8,20H,9H2,(H2,17,18,19).
What are the key properties of 3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol?
3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol has a molecular weight of 263.30 g/mol, XLogP of 3.43, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-anilino-1,4-dihydroindeno[2,1-d]pyrazol-6-ol is sourced from PubChem (CID 137090969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).