N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide

C18H23ClN2O3 — CID 97140752

IUPACN-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide
SMILESCN1C(=O)C[C@@H](NC(=O)CC2(O)CCCC2)[C@H]1c1ccc(Cl)cc1
InChIInChI=1S/C18H23ClN2O3/c1-21-16(23)10-14(17(21)12-4-6-13(19)7-5-12)20-15(22)11-18(24)8-2-3-9-18/h4-7,14,17,24H,2-3,8-11H2,1H3,(H,20,22)/t14-,17-/m1/s1
InChIKeyIHZHQONSSDWWOF-RHSMWYFYSA-N
MW350.85 g/mol
LogP2.42
Rot. Bonds4

About N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide

N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide (PubChem CID 97140752) has the molecular formula C18H23ClN2O3 and a molecular weight of 350.85 g/mol. Its IUPAC name is N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide.

Molecular Properties

Compound NameN-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide
PubChem CID97140752
Molecular FormulaC18H23ClN2O3
Molecular Weight350.85 g/mol
Exact Mass350.14
IUPAC NameN-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide
SMILESCN1C(=O)C[C@@H](NC(=O)CC2(O)CCCC2)[C@H]1c1ccc(Cl)cc1
InChIInChI=1S/C18H23ClN2O3/c1-21-16(23)10-14(17(21)12-4-6-13(19)7-5-12)20-15(22)11-18(24)8-2-3-9-18/h4-7,14,17,24H,2-3,8-11H2,1H3,(H,20,22)/t14-,17-/m1/s1
InChIKeyIHZHQONSSDWWOF-RHSMWYFYSA-N
XLogP2.42
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.85
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide?
The IUPAC name of N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide (CID 97140752) is N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide.
What is the SMILES notation for N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide?
The canonical SMILES for N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide is CN1C(=O)C[C@@H](NC(=O)CC2(O)CCCC2)[C@H]1c1ccc(Cl)cc1.
What is the InChIKey of N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide?
The InChIKey is IHZHQONSSDWWOF-RHSMWYFYSA-N. The full InChI is InChI=1S/C18H23ClN2O3/c1-21-16(23)10-14(17(21)12-4-6-13(19)7-5-12)20-15(22)11-18(24)8-2-3-9-18/h4-7,14,17,24H,2-3,8-11H2,1H3,(H,20,22)/t14-,17-/m1/s1.
What are the key properties of N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide?
N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide has a molecular weight of 350.85 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R,3R)-2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidin-3-yl]-2-(1-hydroxycyclopentyl)acetamide is sourced from PubChem (CID 97140752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).