(2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide

C17H22FN3O2 — CID 1443076

IUPAC(2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide
SMILESO=C(NC1CCCC1)[C@H]1CCCN1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C17H22FN3O2/c18-12-5-3-8-14(11-12)20-17(23)21-10-4-9-15(21)16(22)19-13-6-1-2-7-13/h3,5,8,11,13,15H,1-2,4,6-7,9-10H2,(H,19,22)(H,20,23)/t15-/m1/s1
InChIKeyBPZKMEHHBZDTRK-OAHLLOKOSA-N
MW319.38 g/mol
LogP2.88
Rot. Bonds3

About (2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide

(2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide (PubChem CID 1443076) has the molecular formula C17H22FN3O2 and a molecular weight of 319.38 g/mol. Its IUPAC name is (2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide.

Molecular Properties

Compound Name(2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide
PubChem CID1443076
Molecular FormulaC17H22FN3O2
Molecular Weight319.38 g/mol
Exact Mass319.17
IUPAC Name(2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide
SMILESO=C(NC1CCCC1)[C@H]1CCCN1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C17H22FN3O2/c18-12-5-3-8-14(11-12)20-17(23)21-10-4-9-15(21)16(22)19-13-6-1-2-7-13/h3,5,8,11,13,15H,1-2,4,6-7,9-10H2,(H,19,22)(H,20,23)/t15-/m1/s1
InChIKeyBPZKMEHHBZDTRK-OAHLLOKOSA-N
XLogP2.88
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.38
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-N-(3-fluorophenyl)-2-N-phenylpyrrolidine-1,2-dicarboxamide
CID 1443127
(2S)-2-N-cyclopentyl-1-N-phenylpyrrolidine-1,2-dicarboxamide
CID 1468810
(2S)-2-N-cyclopentyl-1-N-(3-methoxyphenyl)pyrrolidine-1,2-dicarboxamide
CID 1433458
1-[(3-fluorophenyl)carbamoyl]piperidine-2-carboxylic acid
CID 54980760
(2S)-N-cyclopentyl-1-[3-[(3-fluorobenzoyl)amino]benzoyl]pyrrolidine-2-carboxamide
CID 92895034
(2R)-2-N-(2,6-dimethylphenyl)-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide
CID 1443151
2-N-cyclopropyl-1-N-(3-nitrophenyl)pyrrolidine-1,2-dicarboxamide
CID 78877015
2-[(3-fluorophenyl)carbamoyl]piperidine-1-carboxylic acid
CID 175733290
(2R)-1-(3-fluorobenzoyl)-N-(3-fluorophenyl)pyrrolidine-2-carboxamide
CID 51605341
1-N-(2-chloro-4-fluorophenyl)-2-N-cyclopropylpyrrolidine-1,2-dicarboxamide
CID 78896653
(2S)-1-N,2-N-bis(3-chlorophenyl)pyrrolidine-1,2-dicarboxamide
CID 1445725
(2R)-1-N-(4-fluorophenyl)-2-N-phenylpyrrolidine-1,2-dicarboxamide
CID 1445832

Frequently Asked Questions

What is the IUPAC name of (2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide?
The IUPAC name of (2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide (CID 1443076) is (2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide.
What is the SMILES notation for (2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide?
The canonical SMILES for (2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide is O=C(NC1CCCC1)[C@H]1CCCN1C(=O)Nc1cccc(F)c1.
What is the InChIKey of (2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide?
The InChIKey is BPZKMEHHBZDTRK-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H22FN3O2/c18-12-5-3-8-14(11-12)20-17(23)21-10-4-9-15(21)16(22)19-13-6-1-2-7-13/h3,5,8,11,13,15H,1-2,4,6-7,9-10H2,(H,19,22)(H,20,23)/t15-/m1/s1.
What are the key properties of (2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide?
(2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide has a molecular weight of 319.38 g/mol, XLogP of 2.88, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-N-cyclopentyl-1-N-(3-fluorophenyl)pyrrolidine-1,2-dicarboxamide is sourced from PubChem (CID 1443076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).