4-cyclopropyl-1-(4-propylphenyl)pyrazole

C15H18N2 — CID 177016699

IUPAC4-cyclopropyl-1-(4-propylphenyl)pyrazole
SMILESCCCc1ccc(-n2cc(C3CC3)cn2)cc1
InChIInChI=1S/C15H18N2/c1-2-3-12-4-8-15(9-5-12)17-11-14(10-16-17)13-6-7-13/h4-5,8-11,13H,2-3,6-7H2,1H3
InChIKeyTYEWPBHHNDLXTD-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.70
Rot. Bonds4

About 4-cyclopropyl-1-(4-propylphenyl)pyrazole

4-cyclopropyl-1-(4-propylphenyl)pyrazole (PubChem CID 177016699) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 4-cyclopropyl-1-(4-propylphenyl)pyrazole.

Molecular Properties

Compound Name4-cyclopropyl-1-(4-propylphenyl)pyrazole
PubChem CID177016699
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name4-cyclopropyl-1-(4-propylphenyl)pyrazole
SMILESCCCc1ccc(-n2cc(C3CC3)cn2)cc1
InChIInChI=1S/C15H18N2/c1-2-3-12-4-8-15(9-5-12)17-11-14(10-16-17)13-6-7-13/h4-5,8-11,13H,2-3,6-7H2,1H3
InChIKeyTYEWPBHHNDLXTD-UHFFFAOYSA-N
XLogP3.70
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-cyclopropyl-1-(4-propylphenyl)pyrazole 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 4-cyclopropyl-1-(4-propylphenyl)pyrazole?
The IUPAC name of 4-cyclopropyl-1-(4-propylphenyl)pyrazole (CID 177016699) is 4-cyclopropyl-1-(4-propylphenyl)pyrazole.
What is the SMILES notation for 4-cyclopropyl-1-(4-propylphenyl)pyrazole?
The canonical SMILES for 4-cyclopropyl-1-(4-propylphenyl)pyrazole is CCCc1ccc(-n2cc(C3CC3)cn2)cc1.
What is the InChIKey of 4-cyclopropyl-1-(4-propylphenyl)pyrazole?
The InChIKey is TYEWPBHHNDLXTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-2-3-12-4-8-15(9-5-12)17-11-14(10-16-17)13-6-7-13/h4-5,8-11,13H,2-3,6-7H2,1H3.
What are the key properties of 4-cyclopropyl-1-(4-propylphenyl)pyrazole?
4-cyclopropyl-1-(4-propylphenyl)pyrazole has a molecular weight of 226.32 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-1-(4-propylphenyl)pyrazole is sourced from PubChem (CID 177016699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).