2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide

C17H23N3O3 — CID 3231144

IUPAC2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide
SMILESO=C(NC1CCCC1)C1CC(O)CN1C(=O)Nc1ccccc1
InChIInChI=1S/C17H23N3O3/c21-14-10-15(16(22)18-12-8-4-5-9-12)20(11-14)17(23)19-13-6-2-1-3-7-13/h1-3,6-7,12,14-15,21H,4-5,8-11H2,(H,18,22)(H,19,23)
InChIKeyUQOHOVNIKXYTOE-UHFFFAOYSA-N
MW317.39 g/mol
LogP1.71
Rot. Bonds3

About 2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide

2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide (PubChem CID 3231144) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is 2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide
PubChem CID3231144
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC Name2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide
SMILESO=C(NC1CCCC1)C1CC(O)CN1C(=O)Nc1ccccc1
InChIInChI=1S/C17H23N3O3/c21-14-10-15(16(22)18-12-8-4-5-9-12)20(11-14)17(23)19-13-6-2-1-3-7-13/h1-3,6-7,12,14-15,21H,4-5,8-11H2,(H,18,22)(H,19,23)
InChIKeyUQOHOVNIKXYTOE-UHFFFAOYSA-N
XLogP1.71
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 51.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-Hydroxy-pyrrolidine-1,2-dicarboxylic acid 1-phenylamide 2-(2-trifluoromethyl-benzylamide)
CID 6488152
Pyrrolidine-1,2-dicarboxylic acid 2-cyclohexylamide 1-phenylamide
CID 3219761
6-hydroxy-2-phenyltetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione
CID 2767064
4-Hydroxy-pyrrolidine-1,2-dicarboxylic acid 1-phenylamide 2-[(2-o-tolyl-ethyl)-amide]
CID 6488162
Pyrrolidine-1,2-dicarboxylic acid 2-cyclopentylamide 1-phenylamide
CID 655301
Methyl 1-(anilinocarbonyl)-4-hydroxy-2-pyrrolidinecarboxylate
CID 3323238
5-Hydroxy-4-methyl-1-phenylimidazolidin-2-one
CID 13109365
(2R,4R)-1-N-(4-chlorophenyl)-2-N-(2-fluorophenyl)-4-hydroxypyrrolidine-1,2-dicarboxamide
CID 137359279
5-(1-Hydroxyethyl)-3-phenyl-2-thioxoimidazolidin-4-one
CID 3034589
Pyrrolidine-1,2-dicarboxylic acid 2-butylamide 1-phenylamide
CID 3221284
4-Hydroxy-pyrrolidine-1,2-dicarboxylic acid 1-phenylamide 2-[(thiophen-2-ylmethyl)-amide]
CID 6488142
4-Hydroxy-pyrrolidine-1,2-dicarboxylic acid 2-{[2-(3-fluoro-phenyl)-ethyl]-amide} 1-phenylamide
CID 6488154

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide?
The IUPAC name of 2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide (CID 3231144) is 2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide.
What is the SMILES notation for 2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide?
The canonical SMILES for 2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide is O=C(NC1CCCC1)C1CC(O)CN1C(=O)Nc1ccccc1.
What is the InChIKey of 2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide?
The InChIKey is UQOHOVNIKXYTOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c21-14-10-15(16(22)18-12-8-4-5-9-12)20(11-14)17(23)19-13-6-2-1-3-7-13/h1-3,6-7,12,14-15,21H,4-5,8-11H2,(H,18,22)(H,19,23).
What are the key properties of 2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide?
2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide has a molecular weight of 317.39 g/mol, XLogP of 1.71, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopentyl-4-hydroxy-1-N-phenylpyrrolidine-1,2-dicarboxamide is sourced from PubChem (CID 3231144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).