1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide

C19H20FN5O — CID 55644249

IUPAC1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
SMILESCC(Cn1ccnc1)NC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2
InChIInChI=1S/C19H20FN5O/c1-13(11-24-10-9-21-12-24)22-19(26)18-16-3-2-4-17(16)25(23-18)15-7-5-14(20)6-8-15/h5-10,12-13H,2-4,11H2,1H3,(H,22,26)
InChIKeyJKPCACAKSHWDJP-UHFFFAOYSA-N
MW353.40 g/mol
LogP2.52
Rot. Bonds5

About 1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide

1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide (PubChem CID 55644249) has the molecular formula C19H20FN5O and a molecular weight of 353.40 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
PubChem CID55644249
Molecular FormulaC19H20FN5O
Molecular Weight353.40 g/mol
Exact Mass353.17
IUPAC Name1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
SMILESCC(Cn1ccnc1)NC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2
InChIInChI=1S/C19H20FN5O/c1-13(11-24-10-9-21-12-24)22-19(26)18-16-3-2-4-17(16)25(23-18)15-7-5-14(20)6-8-15/h5-10,12-13H,2-4,11H2,1H3,(H,22,26)
InChIKeyJKPCACAKSHWDJP-UHFFFAOYSA-N
XLogP2.52
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.40
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-fluorophenyl)-N-[(1R)-1-pyridin-4-ylethyl]-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 30480120
1-(4-fluorophenyl)-N-pentan-3-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 17499040
1-(4-fluorophenyl)-N-(1-methoxypropan-2-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazole-3-carboxamide
CID 24639520
1-(4-fluorophenyl)-N-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 47017376
1-(4-fluorophenyl)-N-[(1R)-1-(2-methylphenyl)ethyl]-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 25495208
N-[1-(4-fluorophenyl)ethyl]-1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 42929735
1-(4-fluorophenyl)-N-(2-methoxyethyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazole-3-carboxamide
CID 24605170
N-cyclopropyl-1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 18136479
N-[2-(cyclopropanecarbonylamino)ethyl]-1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 51314027
1-(4-fluorophenyl)-N-(3-propan-2-yloxypropyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazole-3-carboxamide
CID 30544749
1-(4-fluorophenyl)-N-[1-(furan-2-yl)ethyl]-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 16597767
N-[2-(dimethylamino)-1-phenylethyl]-1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 42939497

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide (CID 55644249) is 1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide is CC(Cn1ccnc1)NC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2.
What is the InChIKey of 1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide?
The InChIKey is JKPCACAKSHWDJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN5O/c1-13(11-24-10-9-21-12-24)22-19(26)18-16-3-2-4-17(16)25(23-18)15-7-5-14(20)6-8-15/h5-10,12-13H,2-4,11H2,1H3,(H,22,26).
What are the key properties of 1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide?
1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide has a molecular weight of 353.40 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide is sourced from PubChem (CID 55644249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).