2-(5-methyl-1-phenylpyrazol-3-yl)phenol

C16H14N2O — CID 135465497

IUPAC2-(5-methyl-1-phenylpyrazol-3-yl)phenol
SMILESCc1cc(-c2ccccc2O)nn1-c1ccccc1
InChIInChI=1S/C16H14N2O/c1-12-11-15(14-9-5-6-10-16(14)19)17-18(12)13-7-3-2-4-8-13/h2-11,19H,1H3
InChIKeyJNMXTPDNFUNTRA-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.55
Rot. Bonds2

About 2-(5-methyl-1-phenylpyrazol-3-yl)phenol

2-(5-methyl-1-phenylpyrazol-3-yl)phenol (PubChem CID 135465497) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-(5-methyl-1-phenylpyrazol-3-yl)phenol.

Molecular Properties

Compound Name2-(5-methyl-1-phenylpyrazol-3-yl)phenol
PubChem CID135465497
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name2-(5-methyl-1-phenylpyrazol-3-yl)phenol
SMILESCc1cc(-c2ccccc2O)nn1-c1ccccc1
InChIInChI=1S/C16H14N2O/c1-12-11-15(14-9-5-6-10-16(14)19)17-18(12)13-7-3-2-4-8-13/h2-11,19H,1H3
InChIKeyJNMXTPDNFUNTRA-UHFFFAOYSA-N
XLogP3.55
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Propyl pyrazole triol
CID 5040063
2-(3,5-Dimethyl-1-phenylpyrazol-4-yl)phenol
CID 832558
4-Bromo-2-(1-phenyl-1H-pyrazol-5-yl)phenol
CID 838849
1,5-Diphenyl-3-(2-hydroxyethyl)-4-ethylpyrazole
CID 5327639
3-ethyl-2-(4-hydroxyphenyl)-2H-indazol-5-ol
CID 11149479
4-(5-(2,5-dimethylphenyl)-1-methyl-1H-pyrazol-3-yl)phenol
CID 135546507
4-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl]benzenol
CID 1478286
5-(4-Methoxyphenyl)-1,3-diphenyl-1H-pyrazole
CID 14532339
2-[1-(4-methoxybenzyl)-3-phenyl-1H-pyrazol-5-yl]phenol
CID 1038912
2-(1-benzyl-3-phenyl-1H-pyrazol-5-yl)phenol
CID 2380220
Phenol, 4,4',4''-(4-ethyl-1H-pyrazole-1,3,5-triyl)tris-
CID 135484591
(2,3,5,6-tetrafluoro-4-(3-methyl-5-phenyl-1H-pyrazol-1-yl)phenyl)methanol
CID 2274914

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1-phenylpyrazol-3-yl)phenol?
The IUPAC name of 2-(5-methyl-1-phenylpyrazol-3-yl)phenol (CID 135465497) is 2-(5-methyl-1-phenylpyrazol-3-yl)phenol.
What is the SMILES notation for 2-(5-methyl-1-phenylpyrazol-3-yl)phenol?
The canonical SMILES for 2-(5-methyl-1-phenylpyrazol-3-yl)phenol is Cc1cc(-c2ccccc2O)nn1-c1ccccc1.
What is the InChIKey of 2-(5-methyl-1-phenylpyrazol-3-yl)phenol?
The InChIKey is JNMXTPDNFUNTRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c1-12-11-15(14-9-5-6-10-16(14)19)17-18(12)13-7-3-2-4-8-13/h2-11,19H,1H3.
What are the key properties of 2-(5-methyl-1-phenylpyrazol-3-yl)phenol?
2-(5-methyl-1-phenylpyrazol-3-yl)phenol has a molecular weight of 250.30 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1-phenylpyrazol-3-yl)phenol is sourced from PubChem (CID 135465497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).