2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide

C19H19BrN2O2 — CID 110286741

IUPAC2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide
SMILESO=C(N[C@H](C(=O)N1CCCC1)c1ccccc1)c1ccccc1Br
InChIInChI=1S/C19H19BrN2O2/c20-16-11-5-4-10-15(16)18(23)21-17(14-8-2-1-3-9-14)19(24)22-12-6-7-13-22/h1-5,8-11,17H,6-7,12-13H2,(H,21,23)/t17-/m0/s1
InChIKeyQYTTYDVOFDHFCP-KRWDZBQOSA-N
MW387.28 g/mol
LogP3.54
Rot. Bonds4

About 2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide

2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide (PubChem CID 110286741) has the molecular formula C19H19BrN2O2 and a molecular weight of 387.28 g/mol. Its IUPAC name is 2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide.

Molecular Properties

Compound Name2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide
PubChem CID110286741
Molecular FormulaC19H19BrN2O2
Molecular Weight387.28 g/mol
Exact Mass386.06
IUPAC Name2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide
SMILESO=C(N[C@H](C(=O)N1CCCC1)c1ccccc1)c1ccccc1Br
InChIInChI=1S/C19H19BrN2O2/c20-16-11-5-4-10-15(16)18(23)21-17(14-8-2-1-3-9-14)19(24)22-12-6-7-13-22/h1-5,8-11,17H,6-7,12-13H2,(H,21,23)/t17-/m0/s1
InChIKeyQYTTYDVOFDHFCP-KRWDZBQOSA-N
XLogP3.54
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.28
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide 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

2-methyl-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide
CID 110286837
4-chloro-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide
CID 110286769
2-methyl-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]-1H-pyrrole-3-carboxamide
CID 97221761
4-N-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)benzene-1,4-dicarboxamide
CID 90833775
N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-carboxamide
CID 31697369
2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzamide
CID 110286907
4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide
CID 110286844
2,2-dimethyl-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]propanamide
CID 110286834
2-bromo-N-[(S)-cyclopentyl(phenyl)methyl]benzamide
CID 985964
N-[2-(4-aminopiperidin-1-yl)-2-oxo-1-phenylethyl]benzamide
CID 119372896
1-benzyl-3-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]urea
CID 110354058
2-bromo-N-[phenyl-(5-pyrrolidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide
CID 53159583

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide?
The IUPAC name of 2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide (CID 110286741) is 2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide.
What is the SMILES notation for 2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide?
The canonical SMILES for 2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide is O=C(N[C@H](C(=O)N1CCCC1)c1ccccc1)c1ccccc1Br.
What is the InChIKey of 2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide?
The InChIKey is QYTTYDVOFDHFCP-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H19BrN2O2/c20-16-11-5-4-10-15(16)18(23)21-17(14-8-2-1-3-9-14)19(24)22-12-6-7-13-22/h1-5,8-11,17H,6-7,12-13H2,(H,21,23)/t17-/m0/s1.
What are the key properties of 2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide?
2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide has a molecular weight of 387.28 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide is sourced from PubChem (CID 110286741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).