3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol

C17H15N5O — CID 146433270

IUPAC3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol
SMILESCc1cc(-c2ccnn2C)cc2c1nnn2-c1cccc(O)c1
InChIInChI=1S/C17H15N5O/c1-11-8-12(15-6-7-18-21(15)2)9-16-17(11)19-20-22(16)13-4-3-5-14(23)10-13/h3-10,23H,1-2H3
InChIKeyVZLDLWCQRSMNGU-UHFFFAOYSA-N
MW305.34 g/mol
LogP2.84
Rot. Bonds2

About 3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol

3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol (PubChem CID 146433270) has the molecular formula C17H15N5O and a molecular weight of 305.34 g/mol. Its IUPAC name is 3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol.

Molecular Properties

Compound Name3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol
PubChem CID146433270
Molecular FormulaC17H15N5O
Molecular Weight305.34 g/mol
Exact Mass305.13
IUPAC Name3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol
SMILESCc1cc(-c2ccnn2C)cc2c1nnn2-c1cccc(O)c1
InChIInChI=1S/C17H15N5O/c1-11-8-12(15-6-7-18-21(15)2)9-16-17(11)19-20-22(16)13-4-3-5-14(23)10-13/h3-10,23H,1-2H3
InChIKeyVZLDLWCQRSMNGU-UHFFFAOYSA-N
XLogP2.84
TPSA68.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(phenylmethyl)-5-(2-phenylpyrazol-3-yl)-2~{H}-indazol-6-ol
CID 135567434
3-[4-Chloro-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol
CID 155535856
1-(3-Hydroxyphenyl)-6-(2-methylpyrazol-3-yl)benzotriazole-4-carbonitrile
CID 155511330
3-[4-Ethenyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol
CID 155553296
1H-Indazol-4-ol, 1-phenyl-5-(phenylmethyl)-
CID 135705548
3-[4-[4-[3,5-Bis(trifluoromethyl)pyrazol-1-yl]phenyl]triazol-1-yl]phenol
CID 145955949
3-[6-(2-Methylpyrazol-3-yl)benzotriazol-1-yl]phenol
CID 155511705
3-[4-Ethyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol
CID 155523514
3-[4-(2-Hydroxyethylamino)-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol
CID 155524869
3-[4-(Benzylamino)-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol
CID 155539753
3-[4-Methoxy-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol
CID 155563743
3-[6-(2-Methylpyrazol-3-yl)-4-pyrrolidin-1-ylbenzotriazol-1-yl]phenol
CID 155565469

Frequently Asked Questions

What is the IUPAC name of 3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol?
The IUPAC name of 3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol (CID 146433270) is 3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol.
What is the SMILES notation for 3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol?
The canonical SMILES for 3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol is Cc1cc(-c2ccnn2C)cc2c1nnn2-c1cccc(O)c1.
What is the InChIKey of 3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol?
The InChIKey is VZLDLWCQRSMNGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O/c1-11-8-12(15-6-7-18-21(15)2)9-16-17(11)19-20-22(16)13-4-3-5-14(23)10-13/h3-10,23H,1-2H3.
What are the key properties of 3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol?
3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol has a molecular weight of 305.34 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-methyl-6-(2-methylpyrazol-3-yl)benzotriazol-1-yl]phenol is sourced from PubChem (CID 146433270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).