2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine

C17H17N3 — CID 143373997

IUPAC2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine
SMILESCCC(c1ccc(-c2cn[nH]c2)cc1)c1ccccn1
InChIInChI=1S/C17H17N3/c1-2-16(17-5-3-4-10-18-17)14-8-6-13(7-9-14)15-11-19-20-12-15/h3-12,16H,2H2,1H3,(H,19,20)
InChIKeyGRIHYGOOCOKCKE-UHFFFAOYSA-N
MW263.34 g/mol
LogP4.01
Rot. Bonds4

About 2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine

2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine (PubChem CID 143373997) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine.

Molecular Properties

Compound Name2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine
PubChem CID143373997
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC Name2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine
SMILESCCC(c1ccc(-c2cn[nH]c2)cc1)c1ccccn1
InChIInChI=1S/C17H17N3/c1-2-16(17-5-3-4-10-18-17)14-8-6-13(7-9-14)15-11-19-20-12-15/h3-12,16H,2H2,1H3,(H,19,20)
InChIKeyGRIHYGOOCOKCKE-UHFFFAOYSA-N
XLogP4.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine?
The IUPAC name of 2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine (CID 143373997) is 2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine.
What is the SMILES notation for 2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine?
The canonical SMILES for 2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine is CCC(c1ccc(-c2cn[nH]c2)cc1)c1ccccn1.
What is the InChIKey of 2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine?
The InChIKey is GRIHYGOOCOKCKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-2-16(17-5-3-4-10-18-17)14-8-6-13(7-9-14)15-11-19-20-12-15/h3-12,16H,2H2,1H3,(H,19,20).
What are the key properties of 2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine?
2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine has a molecular weight of 263.34 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[4-(1H-pyrazol-4-yl)phenyl]propyl]pyridine is sourced from PubChem (CID 143373997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).