[3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol

C12H12N2O — CID 54512641

IUPAC[3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol
SMILESOCc1cc(C=Cc2ccccc2)n[nH]1
InChIInChI=1S/C12H12N2O/c15-9-12-8-11(13-14-12)7-6-10-4-2-1-3-5-10/h1-8,15H,9H2,(H,13,14)
InChIKeyYKFHXDCJUBLZOW-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.07
Rot. Bonds3

About [3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol

[3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol (PubChem CID 54512641) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is [3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol.

Molecular Properties

Compound Name[3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol
PubChem CID54512641
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name[3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol
SMILESOCc1cc(C=Cc2ccccc2)n[nH]1
InChIInChI=1S/C12H12N2O/c15-9-12-8-11(13-14-12)7-6-10-4-2-1-3-5-10/h1-8,15H,9H2,(H,13,14)
InChIKeyYKFHXDCJUBLZOW-UHFFFAOYSA-N
XLogP2.07
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-2-[3-[(E)-2-phenylethenyl]-2H-indazol-5-yl]ethanone
CID 123456736
2-methoxy-4-[(E)-2-[5-[(E)-2-phenylethenyl]-1H-pyrazol-3-yl]ethenyl]phenol
CID 135453214
[4-[(E)-2-phenylethenyl]-2-pyridinyl]methanol
CID 50983637
4-[2-[4-[4-(2-phenylethenyl)phenyl]phenyl]ethenyl]-2H-triazole
CID 70412416
CID 70567885
CID 70567885
CID 70569152
CID 70569152
3,5-bis(2-phenylethenyl)-2H-indazole
CID 69468999
1-[5-(2-phenylethenyl)-1H-pyrazol-3-yl]propan-1-one
CID 4558473
4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 10591208
2,4-diphenyl-6-[(E)-2-phenylethenyl]pyrimidine
CID 7114809
2,4-diphenyl-6-(2-phenylethenyl)pyridine
CID 3299045
6-(2-phenylethenyl)-3,4-bis(phenylmethoxy)pyridazine
CID 89415006

Frequently Asked Questions

What is the IUPAC name of [3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol?
The IUPAC name of [3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol (CID 54512641) is [3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol.
What is the SMILES notation for [3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol?
The canonical SMILES for [3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol is OCc1cc(C=Cc2ccccc2)n[nH]1.
What is the InChIKey of [3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol?
The InChIKey is YKFHXDCJUBLZOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c15-9-12-8-11(13-14-12)7-6-10-4-2-1-3-5-10/h1-8,15H,9H2,(H,13,14).
What are the key properties of [3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol?
[3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol has a molecular weight of 200.24 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol is sourced from PubChem (CID 54512641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).