4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol

C19H16N2O2 — CID 135566735

IUPAC4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol
SMILESCOc1cc(/C=C/c2[nH]nc3c2Cc2ccccc2-3)ccc1O
InChIInChI=1S/C19H16N2O2/c1-23-18-10-12(7-9-17(18)22)6-8-16-15-11-13-4-2-3-5-14(13)19(15)21-20-16/h2-10,22H,11H2,1H3,(H,20,21)/b8-6+
InChIKeyBCWZYGBFCIHXQS-SOFGYWHQSA-N
MW304.35 g/mol
LogP3.87
Rot. Bonds3

About 4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol

4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol (PubChem CID 135566735) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is 4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol.

Molecular Properties

Compound Name4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol
PubChem CID135566735
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol
SMILESCOc1cc(/C=C/c2[nH]nc3c2Cc2ccccc2-3)ccc1O
InChIInChI=1S/C19H16N2O2/c1-23-18-10-12(7-9-17(18)22)6-8-16-15-11-13-4-2-3-5-14(13)19(15)21-20-16/h2-10,22H,11H2,1H3,(H,20,21)/b8-6+
InChIKeyBCWZYGBFCIHXQS-SOFGYWHQSA-N
XLogP3.87
TPSA58.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Hydrazinocurcumin
CID 135494223
6,7-Dimethoxy-3-[4-(1h-Tetrazol-5-Yl)phenyl]-1,4-Dihydroindeno[1,2-C]pyrazole
CID 44443166
4-[(6,7-Dimethoxy-2,4-Dihydroindeno[1,2-C]pyrazol-3-Yl)ethynyl]-2-Methoxyphenol
CID 44443175
4-(6,7-Dimethoxy-2,4-Dihydroindeno[1,2-C]pyrazol-3-Yl)phenol
CID 135566732
4''-(6,7-Dimethoxy-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)biphenyl-4-ol
CID 136118055
4-[7-Methoxy-6-(tetrahydro-pyran-4-yloxy)-2,4-dihydro-indeno[1,2-c]pyrazol-3-yl]-benzonitrile
CID 44443217
(2R)-3-[[3-[4-(4-hydroxyphenyl)phenyl]-7-methoxy-1,4-dihydroindeno[2,1-d]pyrazol-6-yl]oxy]propane-1,2-diol
CID 135616966
4-[4-[6-Methoxy-7-(2-piperidin-1-ylethoxy)-1,4-dihydroindeno[2,1-d]pyrazol-3-yl]phenyl]phenol
CID 135966067
4-[4-[7-Methoxy-6-(2-pyrrolidin-1-ylethoxy)-1,4-dihydroindeno[2,1-d]pyrazol-3-yl]phenyl]phenol
CID 136118039
2-[[3-[4-(4-Hydroxyphenyl)phenyl]-7-methoxy-1,4-dihydroindeno[2,1-d]pyrazol-6-yl]oxy]propane-1,3-diol
CID 136118040
4-[4-[7-Methoxy-6-(oxolan-3-ylmethoxy)-1,4-dihydroindeno[2,1-d]pyrazol-3-yl]phenyl]phenol
CID 136118043
(2S)-3-[[3-[4-(4-hydroxyphenyl)phenyl]-7-methoxy-1,4-dihydroindeno[2,1-d]pyrazol-6-yl]oxy]propane-1,2-diol
CID 136118052

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol?
The IUPAC name of 4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol (CID 135566735) is 4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol.
What is the SMILES notation for 4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol?
The canonical SMILES for 4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol is COc1cc(/C=C/c2[nH]nc3c2Cc2ccccc2-3)ccc1O.
What is the InChIKey of 4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol?
The InChIKey is BCWZYGBFCIHXQS-SOFGYWHQSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-23-18-10-12(7-9-17(18)22)6-8-16-15-11-13-4-2-3-5-14(13)19(15)21-20-16/h2-10,22H,11H2,1H3,(H,20,21)/b8-6+.
What are the key properties of 4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol?
4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol has a molecular weight of 304.35 g/mol, XLogP of 3.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(2,4-dihydroindeno[1,2-c]pyrazol-3-yl)ethenyl]-2-methoxyphenol is sourced from PubChem (CID 135566735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).