3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole

C10H12N2 — CID 10130101

IUPAC3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole
SMILESCC1=NNC(c2ccccc2)C1
InChIInChI=1S/C10H12N2/c1-8-7-10(12-11-8)9-5-3-2-4-6-9/h2-6,10,12H,7H2,1H3
InChIKeyUFDIVAFBBHFBLU-UHFFFAOYSA-N
MW160.22 g/mol
LogP2.10
Rot. Bonds1

About 3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole

3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole (PubChem CID 10130101) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole.

Molecular Properties

Compound Name3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole
PubChem CID10130101
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole
SMILESCC1=NNC(c2ccccc2)C1
InChIInChI=1S/C10H12N2/c1-8-7-10(12-11-8)9-5-3-2-4-6-9/h2-6,10,12H,7H2,1H3
InChIKeyUFDIVAFBBHFBLU-UHFFFAOYSA-N
XLogP2.10
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole?
The IUPAC name of 3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole (CID 10130101) is 3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole.
What is the SMILES notation for 3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole?
The canonical SMILES for 3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole is CC1=NNC(c2ccccc2)C1.
What is the InChIKey of 3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole?
The InChIKey is UFDIVAFBBHFBLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-8-7-10(12-11-8)9-5-3-2-4-6-9/h2-6,10,12H,7H2,1H3.
What are the key properties of 3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole?
3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole has a molecular weight of 160.22 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-phenyl-4,5-dihydro-1H-pyrazole is sourced from PubChem (CID 10130101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).