2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide

C17H24N2O4 — CID 95303219

IUPAC2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide
SMILESCC[C@@H](CCNC(=O)c1ccc(OC)cc1O)N1CCCC1=O
InChIInChI=1S/C17H24N2O4/c1-3-12(19-10-4-5-16(19)21)8-9-18-17(22)14-7-6-13(23-2)11-15(14)20/h6-7,11-12,20H,3-5,8-10H2,1-2H3,(H,18,22)/t12-/m0/s1
InChIKeyUJLTZSWWIXJQMM-LBPRGKRZSA-N
MW320.39 g/mol
LogP1.92
Rot. Bonds7

About 2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide

2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide (PubChem CID 95303219) has the molecular formula C17H24N2O4 and a molecular weight of 320.39 g/mol. Its IUPAC name is 2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide
PubChem CID95303219
Molecular FormulaC17H24N2O4
Molecular Weight320.39 g/mol
Exact Mass320.17
IUPAC Name2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide
SMILESCC[C@@H](CCNC(=O)c1ccc(OC)cc1O)N1CCCC1=O
InChIInChI=1S/C17H24N2O4/c1-3-12(19-10-4-5-16(19)21)8-9-18-17(22)14-7-6-13(23-2)11-15(14)20/h6-7,11-12,20H,3-5,8-10H2,1-2H3,(H,18,22)/t12-/m0/s1
InChIKeyUJLTZSWWIXJQMM-LBPRGKRZSA-N
XLogP1.92
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethoxy-3-methoxy-N-[3-(2-oxopyrrolidin-1-yl)pentyl]benzamide
CID 51108159
1-ethyl-2-[(4-methoxyphenyl)methyl]-3-[3-(2-oxopyrrolidin-1-yl)pentyl]guanidine;hydroiodide
CID 111183829
2-hydroxy-4-methoxy-N-(3-methylsulfanylbutyl)benzamide
CID 115604496
N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]-2-phenoxyacetamide
CID 52869830
2-hydroxy-N-(3-hydroxypropyl)-4-methoxybenzamide
CID 43390117
2-hydroxy-4-methoxy-N-(3-methoxypropyl)benzamide
CID 43090058
2-hydroxy-4-methoxy-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide
CID 51186865
N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2-hydroxy-4-methoxybenzamide
CID 49090761
2-hydroxy-4-methoxy-N-[3-(methylamino)-3-oxopropyl]benzamide
CID 47415526
2-hydroxy-4-methoxy-N-[(2-methylpyrrolidin-2-yl)methyl]benzamide
CID 114761721
2-hydroxy-4-methoxy-N-(4-methylsulfanylbutyl)benzamide
CID 113238429
N-[2-ethyl-2-(hydroxymethyl)butyl]-2-hydroxy-4-methoxybenzamide
CID 103844616

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide?
The IUPAC name of 2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide (CID 95303219) is 2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide.
What is the SMILES notation for 2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide?
The canonical SMILES for 2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide is CC[C@@H](CCNC(=O)c1ccc(OC)cc1O)N1CCCC1=O.
What is the InChIKey of 2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide?
The InChIKey is UJLTZSWWIXJQMM-LBPRGKRZSA-N. The full InChI is InChI=1S/C17H24N2O4/c1-3-12(19-10-4-5-16(19)21)8-9-18-17(22)14-7-6-13(23-2)11-15(14)20/h6-7,11-12,20H,3-5,8-10H2,1-2H3,(H,18,22)/t12-/m0/s1.
What are the key properties of 2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide?
2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide has a molecular weight of 320.39 g/mol, XLogP of 1.92, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-methoxy-N-[(3S)-3-(2-oxopyrrolidin-1-yl)pentyl]benzamide is sourced from PubChem (CID 95303219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).