1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole

C14H16N2 — CID 121214529

IUPAC1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole
SMILESCCn1nc(-c2ccccc2)c2c1CCC2
InChIInChI=1S/C14H16N2/c1-2-16-13-10-6-9-12(13)14(15-16)11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3
InChIKeyKARYHOGOGQEXPW-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.06
Rot. Bonds2

About 1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole

1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole (PubChem CID 121214529) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole.

Molecular Properties

Compound Name1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole
PubChem CID121214529
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole
SMILESCCn1nc(-c2ccccc2)c2c1CCC2
InChIInChI=1S/C14H16N2/c1-2-16-13-10-6-9-12(13)14(15-16)11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3
InChIKeyKARYHOGOGQEXPW-UHFFFAOYSA-N
XLogP3.06
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 121214632
1-ethyl-3-methyl-4,5,6,7-tetrahydroindazole
CID 121292185
1-[(2-fluorophenyl)methyl]-3-pyrimidin-5-yl-4,5,6,7-tetrahydroindazole
CID 53391158
1-ethyl-3-(3-iodophenyl)-5,6,7,8-tetrahydro-4H-pyrazolo[5,4-b]azepine
CID 3960672
3-[(3-methyl-5-phenyl-1,2,4-triazol-1-yl)methyl]-1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole
CID 56528673
1-ethyl-3-pyridin-2-yl-6,7-dihydro-4H-thiopyrano[4,3-c]pyrazole
CID 121214700
1-(4-ethylphenyl)-3-(4-phenylphenyl)-5,6,7,8-tetrahydro-4H-pyrazolo[5,4-b]azepine
CID 4255284
N-(4-ethylphenyl)-2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2-yl)acetamide
CID 23608927
3-phenylsulfanyl-N-[2-(3-pyridin-4-yl-4,5,6,7-tetrahydroindazol-1-yl)ethyl]propanamide
CID 72718483
3-ethyl-2-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
CID 146618854
7-methylidene-3-phenyl-5,6-dihydro-4H-triazolo[1,5-a]pyridine
CID 122398556
3-(4-chlorophenyl)-1-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[4,5-d]azepine
CID 59752588

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole?
The IUPAC name of 1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole (CID 121214529) is 1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole.
What is the SMILES notation for 1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole?
The canonical SMILES for 1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole is CCn1nc(-c2ccccc2)c2c1CCC2.
What is the InChIKey of 1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole?
The InChIKey is KARYHOGOGQEXPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-2-16-13-10-6-9-12(13)14(15-16)11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3.
What are the key properties of 1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole?
1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole has a molecular weight of 212.30 g/mol, XLogP of 3.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole is sourced from PubChem (CID 121214529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).