[(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone

C23H23FN4O — CID 166243193

IUPAC[(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone
SMILESN[C@@H]1C[C@H](c2ccccc2)N(C(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C1
InChIInChI=1S/C23H23FN4O/c24-16-9-11-18(12-10-16)28-20-8-4-7-19(20)22(26-28)23(29)27-14-17(25)13-21(27)15-5-2-1-3-6-15/h1-3,5-6,9-12,17,21H,4,7-8,13-14,25H2/t17-,21-/m1/s1
InChIKeyKULKGZPGKLSQJL-DYESRHJHSA-N
MW390.46 g/mol
LogP3.41
Rot. Bonds3

About [(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone

[(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone (PubChem CID 166243193) has the molecular formula C23H23FN4O and a molecular weight of 390.46 g/mol. Its IUPAC name is [(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone.

Molecular Properties

Compound Name[(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone
PubChem CID166243193
Molecular FormulaC23H23FN4O
Molecular Weight390.46 g/mol
Exact Mass390.19
IUPAC Name[(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone
SMILESN[C@@H]1C[C@H](c2ccccc2)N(C(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C1
InChIInChI=1S/C23H23FN4O/c24-16-9-11-18(12-10-16)28-20-8-4-7-19(20)22(26-28)23(29)27-14-17(25)13-21(27)15-5-2-1-3-6-15/h1-3,5-6,9-12,17,21H,4,7-8,13-14,25H2/t17-,21-/m1/s1
InChIKeyKULKGZPGKLSQJL-DYESRHJHSA-N
XLogP3.41
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.46
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4-hydroxy-2-phenylpyrrolidin-1-yl)-(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanone
CID 154736556
[2-(4-fluorophenyl)pyrrolidin-1-yl]-[1-(4-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone
CID 55597209
[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]methanone
CID 30906678
4-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbonyl]morpholine-3-carboxylic acid
CID 119216827
(4-amino-2-methylpyrrolidin-1-yl)-[1-(2,4-difluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone
CID 166298629
(3S)-1-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbonyl]piperidine-3-carboxylic acid
CID 119113579
(4-aminopiperidin-1-yl)-(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanone;hydrochloride
CID 119373981
N-cyclopropyl-1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 18136479
[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanone
CID 120657503
2-[[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbonyl]-methylamino]acetic acid
CID 119172389
2-[ethyl-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carbonyl]amino]acetic acid
CID 119206416
1-(4-fluorophenyl)-N-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 47017376

Frequently Asked Questions

What is the IUPAC name of [(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone?
The IUPAC name of [(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone (CID 166243193) is [(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone.
What is the SMILES notation for [(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone?
The canonical SMILES for [(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone is N[C@@H]1C[C@H](c2ccccc2)N(C(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C1.
What is the InChIKey of [(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone?
The InChIKey is KULKGZPGKLSQJL-DYESRHJHSA-N. The full InChI is InChI=1S/C23H23FN4O/c24-16-9-11-18(12-10-16)28-20-8-4-7-19(20)22(26-28)23(29)27-14-17(25)13-21(27)15-5-2-1-3-6-15/h1-3,5-6,9-12,17,21H,4,7-8,13-14,25H2/t17-,21-/m1/s1.
What are the key properties of [(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone?
[(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone has a molecular weight of 390.46 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,4R)-4-amino-2-phenylpyrrolidin-1-yl]-[1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl]methanone is sourced from PubChem (CID 166243193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).