3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide

C20H25FN4O2 — CID 134056955

IUPAC3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide
SMILESO=C(NCC(c1ccco1)N1CCCC1)C1CNNC1c1ccc(F)cc1
InChIInChI=1S/C20H25FN4O2/c21-15-7-5-14(6-8-15)19-16(12-23-24-19)20(26)22-13-17(18-4-3-11-27-18)25-9-1-2-10-25/h3-8,11,16-17,19,23-24H,1-2,9-10,12-13H2,(H,22,26)
InChIKeyWHWODLOGHHZHIJ-UHFFFAOYSA-N
MW372.44 g/mol
LogP2.14
Rot. Bonds6

About 3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide

3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide (PubChem CID 134056955) has the molecular formula C20H25FN4O2 and a molecular weight of 372.44 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide
PubChem CID134056955
Molecular FormulaC20H25FN4O2
Molecular Weight372.44 g/mol
Exact Mass372.20
IUPAC Name3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide
SMILESO=C(NCC(c1ccco1)N1CCCC1)C1CNNC1c1ccc(F)cc1
InChIInChI=1S/C20H25FN4O2/c21-15-7-5-14(6-8-15)19-16(12-23-24-19)20(26)22-13-17(18-4-3-11-27-18)25-9-1-2-10-25/h3-8,11,16-17,19,23-24H,1-2,9-10,12-13H2,(H,22,26)
InChIKeyWHWODLOGHHZHIJ-UHFFFAOYSA-N
XLogP2.14
TPSA69.54 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.44
LogP ≤ 52.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide 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

N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopropanecarboxamide
CID 7780302
N-[(2R)-2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(furan-2-yl)ethyl]cyclopropanecarboxamide
CID 7162829
4-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-oxobutanamide
CID 110302511
(3R)-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-6-oxopiperidine-3-carboxamide
CID 94152825
(3R)-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-6-oxopiperidine-3-carboxamide
CID 94165357
(3R)-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-6-oxopiperidine-3-carboxamide
CID 94165356
4-N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]piperidine-1,4-dicarboxamide
CID 94164796
4-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]piperidine-1,4-dicarboxamide
CID 94164797
1-(cyclopropanecarbonyl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]piperidine-4-carboxamide
CID 51162652
2-fluoro-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide
CID 26834331
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-1,1-dioxothiolane-3-carboxamide
CID 134057186
N-[(4-fluorophenyl)methyl]-N'-[(2S)-2-(furan-2-yl)-2-morpholin-4-ylethyl]oxamide
CID 7217195

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide?
The IUPAC name of 3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide (CID 134056955) is 3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide is O=C(NCC(c1ccco1)N1CCCC1)C1CNNC1c1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide?
The InChIKey is WHWODLOGHHZHIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25FN4O2/c21-15-7-5-14(6-8-15)19-16(12-23-24-19)20(26)22-13-17(18-4-3-11-27-18)25-9-1-2-10-25/h3-8,11,16-17,19,23-24H,1-2,9-10,12-13H2,(H,22,26).
What are the key properties of 3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide?
3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide has a molecular weight of 372.44 g/mol, XLogP of 2.14, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pyrazolidine-4-carboxamide is sourced from PubChem (CID 134056955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).