(2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide

C16H20ClN3O3 — CID 124701714

IUPAC(2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide
SMILESO=C(N[C@@H]1CCCN(c2ccccc2Cl)C1=O)[C@H]1C[C@@H](O)CN1
InChIInChI=1S/C16H20ClN3O3/c17-11-4-1-2-6-14(11)20-7-3-5-12(16(20)23)19-15(22)13-8-10(21)9-18-13/h1-2,4,6,10,12-13,18,21H,3,5,7-9H2,(H,19,22)/t10-,12-,13-/m1/s1
InChIKeyLNUUOQIVEMREMI-RAIGVLPGSA-N
MW337.81 g/mol
LogP0.67
Rot. Bonds3

About (2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide

(2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide (PubChem CID 124701714) has the molecular formula C16H20ClN3O3 and a molecular weight of 337.81 g/mol. Its IUPAC name is (2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide
PubChem CID124701714
Molecular FormulaC16H20ClN3O3
Molecular Weight337.81 g/mol
Exact Mass337.12
IUPAC Name(2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide
SMILESO=C(N[C@@H]1CCCN(c2ccccc2Cl)C1=O)[C@H]1C[C@@H](O)CN1
InChIInChI=1S/C16H20ClN3O3/c17-11-4-1-2-6-14(11)20-7-3-5-12(16(20)23)19-15(22)13-8-10(21)9-18-13/h1-2,4,6,10,12-13,18,21H,3,5,7-9H2,(H,19,22)/t10-,12-,13-/m1/s1
InChIKeyLNUUOQIVEMREMI-RAIGVLPGSA-N
XLogP0.67
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.81
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-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-[1-(2-chlorophenyl)-2-oxopyrrolidin-3-yl]piperidine-2-carboxamide;hydrochloride
CID 119321185
N-[1-(2-chlorophenyl)-2-oxopiperidin-3-yl]morpholine-2-carboxamide;hydrochloride
CID 119802816
N-[1-(3-chlorophenyl)-2-oxopyrrolidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 119814123
1-[1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-3-ethylurea
CID 71994500
1-(2-chlorophenyl)-3-hydroxypiperidin-2-one
CID 117014113
1-amino-N-[1-(2-chlorophenyl)-2-oxopiperidin-3-yl]cyclohexane-1-carboxamide
CID 119334574
2-amino-N-[1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-2-phenylacetamide;hydrochloride
CID 119334565
N-[1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-2-methylsulfonylpropanamide
CID 136527689
N-[1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-methoxypiperidine-4-carboxamide
CID 119802811
4-hydroxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-2-carboxamide
CID 43652030
(2R,4R)-4-hydroxy-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine-2-carboxamide
CID 124670344
3-amino-N-[1-(2-chlorophenyl)-2-oxopyrrolidin-3-yl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119779533

Frequently Asked Questions

What is the IUPAC name of (2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide?
The IUPAC name of (2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide (CID 124701714) is (2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide.
What is the SMILES notation for (2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide?
The canonical SMILES for (2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide is O=C(N[C@@H]1CCCN(c2ccccc2Cl)C1=O)[C@H]1C[C@@H](O)CN1.
What is the InChIKey of (2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide?
The InChIKey is LNUUOQIVEMREMI-RAIGVLPGSA-N. The full InChI is InChI=1S/C16H20ClN3O3/c17-11-4-1-2-6-14(11)20-7-3-5-12(16(20)23)19-15(22)13-8-10(21)9-18-13/h1-2,4,6,10,12-13,18,21H,3,5,7-9H2,(H,19,22)/t10-,12-,13-/m1/s1.
What are the key properties of (2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide?
(2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide has a molecular weight of 337.81 g/mol, XLogP of 0.67, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R)-N-[(3R)-1-(2-chlorophenyl)-2-oxopiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide is sourced from PubChem (CID 124701714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).