[2-(2-phenylpyrazol-3-yl)phenyl]methanamine

C16H15N3 — CID 107330991

IUPAC[2-(2-phenylpyrazol-3-yl)phenyl]methanamine
SMILESNCc1ccccc1-c1ccnn1-c1ccccc1
InChIInChI=1S/C16H15N3/c17-12-13-6-4-5-9-15(13)16-10-11-18-19(16)14-7-2-1-3-8-14/h1-11H,12,17H2
InChIKeyBMEVJECFHUDEMR-UHFFFAOYSA-N
MW249.32 g/mol
LogP3.00
Rot. Bonds3

About [2-(2-phenylpyrazol-3-yl)phenyl]methanamine

[2-(2-phenylpyrazol-3-yl)phenyl]methanamine (PubChem CID 107330991) has the molecular formula C16H15N3 and a molecular weight of 249.32 g/mol. Its IUPAC name is [2-(2-phenylpyrazol-3-yl)phenyl]methanamine.

Molecular Properties

Compound Name[2-(2-phenylpyrazol-3-yl)phenyl]methanamine
PubChem CID107330991
Molecular FormulaC16H15N3
Molecular Weight249.32 g/mol
Exact Mass249.13
IUPAC Name[2-(2-phenylpyrazol-3-yl)phenyl]methanamine
SMILESNCc1ccccc1-c1ccnn1-c1ccccc1
InChIInChI=1S/C16H15N3/c17-12-13-6-4-5-9-15(13)16-10-11-18-19(16)14-7-2-1-3-8-14/h1-11H,12,17H2
InChIKeyBMEVJECFHUDEMR-UHFFFAOYSA-N
XLogP3.00
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(3-phenyltriazol-4-yl)phenyl]methanamine
CID 114689604
[2-(2-propylpyrazol-3-yl)phenyl]methanamine
CID 63974811
6-methyl-5-(2-phenylpyrazol-3-yl)pyridin-2-amine
CID 107330989
2-(2-phenylpyrazol-3-yl)propan-1-amine
CID 105453704
5-benzyl-1-phenylpyrazole
CID 14003889
1-[4-(2-phenylpyrazol-3-yl)phenyl]propan-1-amine
CID 107331073
1-[4-(2-phenylpyrazol-3-yl)phenyl]ethanamine
CID 107331022
2-methyl-4-(2-phenylpyrazol-3-yl)aniline
CID 107331021
2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine
CID 107331496
1-[4-fluoro-3-(2-phenylpyrazol-3-yl)phenyl]-N-methylmethanamine
CID 107331058
1-phenyl-5-(5-phenylthiophen-2-yl)pyrazole
CID 59632631
5-(2-phenylpyrazol-3-yl)benzene-1,2,3-triol
CID 135923293

Frequently Asked Questions

What is the IUPAC name of [2-(2-phenylpyrazol-3-yl)phenyl]methanamine?
The IUPAC name of [2-(2-phenylpyrazol-3-yl)phenyl]methanamine (CID 107330991) is [2-(2-phenylpyrazol-3-yl)phenyl]methanamine.
What is the SMILES notation for [2-(2-phenylpyrazol-3-yl)phenyl]methanamine?
The canonical SMILES for [2-(2-phenylpyrazol-3-yl)phenyl]methanamine is NCc1ccccc1-c1ccnn1-c1ccccc1.
What is the InChIKey of [2-(2-phenylpyrazol-3-yl)phenyl]methanamine?
The InChIKey is BMEVJECFHUDEMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3/c17-12-13-6-4-5-9-15(13)16-10-11-18-19(16)14-7-2-1-3-8-14/h1-11H,12,17H2.
What are the key properties of [2-(2-phenylpyrazol-3-yl)phenyl]methanamine?
[2-(2-phenylpyrazol-3-yl)phenyl]methanamine has a molecular weight of 249.32 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-phenylpyrazol-3-yl)phenyl]methanamine is sourced from PubChem (CID 107330991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).