3-(pyrazol-1-ylmethyl)phenol

C10H10N2O — CID 24745197

IUPAC3-(pyrazol-1-ylmethyl)phenol
SMILESOc1cccc(Cn2cccn2)c1
InChIInChI=1S/C10H10N2O/c13-10-4-1-3-9(7-10)8-12-6-2-5-11-12/h1-7,13H,8H2
InChIKeySYRAYGFUBLQCKO-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.64
Rot. Bonds2

About 3-(pyrazol-1-ylmethyl)phenol

3-(pyrazol-1-ylmethyl)phenol (PubChem CID 24745197) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 3-(pyrazol-1-ylmethyl)phenol.

Molecular Properties

Compound Name3-(pyrazol-1-ylmethyl)phenol
PubChem CID24745197
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name3-(pyrazol-1-ylmethyl)phenol
SMILESOc1cccc(Cn2cccn2)c1
InChIInChI=1S/C10H10N2O/c13-10-4-1-3-9(7-10)8-12-6-2-5-11-12/h1-7,13H,8H2
InChIKeySYRAYGFUBLQCKO-UHFFFAOYSA-N
XLogP1.64
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(pyrazol-1-ylmethyl)anilino]methyl]phenol
CID 43693851
trimethyl-[3-(pyrazol-1-ylmethyl)phenyl]silane
CID 141433506
2-[3-(pyrazol-1-ylmethyl)phenyl]acetaldehyde
CID 123588781
1-[(3-hydroxybenzoyl)amino]-3-[3-(pyrazol-1-ylmethyl)phenyl]urea
CID 75400123
N-[(3-hydroxyphenyl)methylideneamino]-3-(pyrazol-1-ylmethyl)benzamide
CID 724894
N'-hydroxy-3-(pyrazol-1-ylmethyl)benzenecarboximidamide
CID 24695013
3-[3-(pyrazol-1-ylmethyl)phenyl]benzoic acid
CID 142326100
1-methyl-4-[[3-(pyrazol-1-ylmethyl)phenyl]methyl]piperazine
CID 141348331
[4-(pyrazol-1-ylmethyl)phenyl]methanol
CID 16640562
1-amino-N-[[3-(pyrazol-1-ylmethyl)phenyl]methyl]cyclopropane-1-carboxamide
CID 119744676
2-amino-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
CID 43697313
3-[[4-(6-pyrazol-1-ylpyrazin-2-yl)piperazin-1-yl]methyl]phenol
CID 84584722

Frequently Asked Questions

What is the IUPAC name of 3-(pyrazol-1-ylmethyl)phenol?
The IUPAC name of 3-(pyrazol-1-ylmethyl)phenol (CID 24745197) is 3-(pyrazol-1-ylmethyl)phenol.
What is the SMILES notation for 3-(pyrazol-1-ylmethyl)phenol?
The canonical SMILES for 3-(pyrazol-1-ylmethyl)phenol is Oc1cccc(Cn2cccn2)c1.
What is the InChIKey of 3-(pyrazol-1-ylmethyl)phenol?
The InChIKey is SYRAYGFUBLQCKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c13-10-4-1-3-9(7-10)8-12-6-2-5-11-12/h1-7,13H,8H2.
What are the key properties of 3-(pyrazol-1-ylmethyl)phenol?
3-(pyrazol-1-ylmethyl)phenol has a molecular weight of 174.20 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(pyrazol-1-ylmethyl)phenol is sourced from PubChem (CID 24745197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).