3-(1-benzylpyrazol-3-yl)pyridine

C15H13N3 — CID 99964671

IUPAC3-(1-benzylpyrazol-3-yl)pyridine
SMILESc1ccc(Cn2ccc(-c3cccnc3)n2)cc1
InChIInChI=1S/C15H13N3/c1-2-5-13(6-3-1)12-18-10-8-15(17-18)14-7-4-9-16-11-14/h1-11H,12H2
InChIKeyHVDOPFQCCLUIQV-UHFFFAOYSA-N
MW235.29 g/mol
LogP2.99
Rot. Bonds3

About 3-(1-benzylpyrazol-3-yl)pyridine

3-(1-benzylpyrazol-3-yl)pyridine (PubChem CID 99964671) has the molecular formula C15H13N3 and a molecular weight of 235.29 g/mol. Its IUPAC name is 3-(1-benzylpyrazol-3-yl)pyridine.

Molecular Properties

Compound Name3-(1-benzylpyrazol-3-yl)pyridine
PubChem CID99964671
Molecular FormulaC15H13N3
Molecular Weight235.29 g/mol
Exact Mass235.11
IUPAC Name3-(1-benzylpyrazol-3-yl)pyridine
SMILESc1ccc(Cn2ccc(-c3cccnc3)n2)cc1
InChIInChI=1S/C15H13N3/c1-2-5-13(6-3-1)12-18-10-8-15(17-18)14-7-4-9-16-11-14/h1-11H,12H2
InChIKeyHVDOPFQCCLUIQV-UHFFFAOYSA-N
XLogP2.99
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]pyridine
CID 99964672
2-[3-phenyl-5-[1-(pyridin-3-ylmethyl)pyrazol-3-yl]anilino]acetic acid
CID 168965601
4-[(3-phenylpyrazol-1-yl)methyl]phenol
CID 59752932
3-(1-sulfanylpyrazol-3-yl)pyridine
CID 67474504
2-[2-(3-pyridin-3-ylpyrazol-1-yl)ethyl]isoindole-1,3-dione
CID 155798792
2-(1-benzylpyrazol-3-yl)pyridine
CID 71374413
3-(1-fluoropyrazol-3-yl)pyridine
CID 174166820
4-methoxy-2-[3-[1-(pyridin-3-ylmethyl)pyrazol-3-yl]phenyl]pyrimidine
CID 28664911
2-[[[4-phenyl-2-[1-(pyridin-3-ylmethyl)pyrazol-3-yl]phenyl]methylamino]methyl]prop-2-enal
CID 170003197
2-[(3-phenylpyrazol-1-yl)methyl]pyridine
CID 118497014
1-[2-phenyl-4-[1-(pyridin-3-ylmethyl)pyrazol-3-yl]-5,7-dihydropyrrolo[3,4-d]pyrimidin-6-yl]prop-2-en-1-one
CID 169130130
3-[2-[3-(3-bromophenyl)pyrazol-1-yl]ethyl]pyridine
CID 168964871

Frequently Asked Questions

What is the IUPAC name of 3-(1-benzylpyrazol-3-yl)pyridine?
The IUPAC name of 3-(1-benzylpyrazol-3-yl)pyridine (CID 99964671) is 3-(1-benzylpyrazol-3-yl)pyridine.
What is the SMILES notation for 3-(1-benzylpyrazol-3-yl)pyridine?
The canonical SMILES for 3-(1-benzylpyrazol-3-yl)pyridine is c1ccc(Cn2ccc(-c3cccnc3)n2)cc1.
What is the InChIKey of 3-(1-benzylpyrazol-3-yl)pyridine?
The InChIKey is HVDOPFQCCLUIQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3/c1-2-5-13(6-3-1)12-18-10-8-15(17-18)14-7-4-9-16-11-14/h1-11H,12H2.
What are the key properties of 3-(1-benzylpyrazol-3-yl)pyridine?
3-(1-benzylpyrazol-3-yl)pyridine has a molecular weight of 235.29 g/mol, XLogP of 2.99, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-benzylpyrazol-3-yl)pyridine is sourced from PubChem (CID 99964671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).