N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide

C20H22N2O3 — CID 111334828

IUPACN-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESCC(O)(CNC(=O)c1ccc(N2CCCC2=O)cc1)c1ccccc1
InChIInChI=1S/C20H22N2O3/c1-20(25,16-6-3-2-4-7-16)14-21-19(24)15-9-11-17(12-10-15)22-13-5-8-18(22)23/h2-4,6-7,9-12,25H,5,8,13-14H2,1H3,(H,21,24)
InChIKeyZCVNZHGDCFHROK-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.45
Rot. Bonds5

About N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide

N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 111334828) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide
PubChem CID111334828
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC NameN-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESCC(O)(CNC(=O)c1ccc(N2CCCC2=O)cc1)c1ccccc1
InChIInChI=1S/C20H22N2O3/c1-20(25,16-6-3-2-4-7-16)14-21-19(24)15-9-11-17(12-10-15)22-13-5-8-18(22)23/h2-4,6-7,9-12,25H,5,8,13-14H2,1H3,(H,21,24)
InChIKeyZCVNZHGDCFHROK-UHFFFAOYSA-N
XLogP2.45
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-benzamidoethyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 24659936
N-(2-methyl-2-phenylpropyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 46414391
N-(4-hydroxy-2,2-dimethylpentyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 111480504
N-[2-(dimethylamino)-2-phenylethyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 4881454
4-(2-oxopyrrolidin-1-yl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
CID 8589075
N-(2-hydroxy-2-phenylpropyl)-4-methylbenzamide
CID 110663962
N-[(2R)-2-hydroxy-2-phenylpropyl]-N'-[3-(2-oxopiperidin-1-yl)phenyl]oxamide
CID 95368106
N-[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl]benzamide
CID 8745955
N-[2-(2-hydroxyphenyl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 110619378
N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 9041718
4-(2-oxopyrrolidin-1-yl)-N-(1-phenylpropylideneamino)benzamide
CID 790502
4-(2-oxopyrrolidin-1-yl)-N-[2-(pyrimidin-2-ylamino)ethyl]benzamide
CID 51081174

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide (CID 111334828) is N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide is CC(O)(CNC(=O)c1ccc(N2CCCC2=O)cc1)c1ccccc1.
What is the InChIKey of N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is ZCVNZHGDCFHROK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-20(25,16-6-3-2-4-7-16)14-21-19(24)15-9-11-17(12-10-15)22-13-5-8-18(22)23/h2-4,6-7,9-12,25H,5,8,13-14H2,1H3,(H,21,24).
What are the key properties of N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 338.41 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-phenylpropyl)-4-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 111334828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).