1-methyl-5-(2-phenylethenyl)pyrazole

C12H12N2 — CID 71401987

IUPAC1-methyl-5-(2-phenylethenyl)pyrazole
SMILESCn1nccc1C=Cc1ccccc1
InChIInChI=1S/C12H12N2/c1-14-12(9-10-13-14)8-7-11-5-3-2-4-6-11/h2-10H,1H3
InChIKeyAKWFQHRZPGKCGH-UHFFFAOYSA-N
MW184.24 g/mol
LogP2.59
Rot. Bonds2

About 1-methyl-5-(2-phenylethenyl)pyrazole

1-methyl-5-(2-phenylethenyl)pyrazole (PubChem CID 71401987) has the molecular formula C12H12N2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 1-methyl-5-(2-phenylethenyl)pyrazole.

Molecular Properties

Compound Name1-methyl-5-(2-phenylethenyl)pyrazole
PubChem CID71401987
Molecular FormulaC12H12N2
Molecular Weight184.24 g/mol
Exact Mass184.10
IUPAC Name1-methyl-5-(2-phenylethenyl)pyrazole
SMILESCn1nccc1C=Cc1ccccc1
InChIInChI=1S/C12H12N2/c1-14-12(9-10-13-14)8-7-11-5-3-2-4-6-11/h2-10H,1H3
InChIKeyAKWFQHRZPGKCGH-UHFFFAOYSA-N
XLogP2.59
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

trifluoro-[(E)-2-(2-methylpyrazol-3-yl)ethenyl]boranuide
CID 167737217
1-methyl-5-[(1Z)-3-methylbuta-1,3-dienyl]pyrazole
CID 166472401
4-(2-methylpyrazol-3-yl)but-3-ene-1-thiol
CID 170479344
3-[2-[(Z)-2-(2-methylpyrazol-3-yl)ethenyl]-4-oxoquinazolin-3-yl]propanoic acid
CID 97449963
methanol;2-methylpyrazole-3-carbaldehyde
CID 143813492
2-[2,5-bis[(E)-2-phenylethenyl]pyrrol-1-yl]pyrimidine
CID 132563197
CID 70567885
CID 70567885
CID 70569152
CID 70569152
N,N-dimethylmethanamine;stilbene
CID 174368184
4-(2-phenylethenyl)pyridine;hydrochloride
CID 71352999
disodium;hydride;(E)-stilbene
CID 173089328
hydride;rubidium(1+);stilbene
CID 173437843

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-(2-phenylethenyl)pyrazole?
The IUPAC name of 1-methyl-5-(2-phenylethenyl)pyrazole (CID 71401987) is 1-methyl-5-(2-phenylethenyl)pyrazole.
What is the SMILES notation for 1-methyl-5-(2-phenylethenyl)pyrazole?
The canonical SMILES for 1-methyl-5-(2-phenylethenyl)pyrazole is Cn1nccc1C=Cc1ccccc1.
What is the InChIKey of 1-methyl-5-(2-phenylethenyl)pyrazole?
The InChIKey is AKWFQHRZPGKCGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2/c1-14-12(9-10-13-14)8-7-11-5-3-2-4-6-11/h2-10H,1H3.
What are the key properties of 1-methyl-5-(2-phenylethenyl)pyrazole?
1-methyl-5-(2-phenylethenyl)pyrazole has a molecular weight of 184.24 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(2-phenylethenyl)pyrazole is sourced from PubChem (CID 71401987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).