5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole

C10H12N2 — CID 70515564

IUPAC5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole
SMILESCc1ccc(C2=CCNN2)cc1
InChIInChI=1S/C10H12N2/c1-8-2-4-9(5-3-8)10-6-7-11-12-10/h2-6,11-12H,7H2,1H3
InChIKeyOSKIFXGALMCAGH-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.44
Rot. Bonds1

About 5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole

5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole (PubChem CID 70515564) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole.

Molecular Properties

Compound Name5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole
PubChem CID70515564
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole
SMILESCc1ccc(C2=CCNN2)cc1
InChIInChI=1S/C10H12N2/c1-8-2-4-9(5-3-8)10-6-7-11-12-10/h2-6,11-12H,7H2,1H3
InChIKeyOSKIFXGALMCAGH-UHFFFAOYSA-N
XLogP1.44
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole?
The IUPAC name of 5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole (CID 70515564) is 5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole.
What is the SMILES notation for 5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole?
The canonical SMILES for 5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole is Cc1ccc(C2=CCNN2)cc1.
What is the InChIKey of 5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole?
The InChIKey is OSKIFXGALMCAGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-8-2-4-9(5-3-8)10-6-7-11-12-10/h2-6,11-12H,7H2,1H3.
What are the key properties of 5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole?
5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole has a molecular weight of 160.22 g/mol, XLogP of 1.44, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenyl)-2,3-dihydro-1H-pyrazole is sourced from PubChem (CID 70515564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).