3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide

C15H20N2O4 — CID 115674973

IUPAC3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide
SMILESCOc1ccc(C(=O)NC(C)C(=O)N2CCCC2)cc1O
InChIInChI=1S/C15H20N2O4/c1-10(15(20)17-7-3-4-8-17)16-14(19)11-5-6-13(21-2)12(18)9-11/h5-6,9-10,18H,3-4,7-8H2,1-2H3,(H,16,19)
InChIKeyHDEVPWIKVCMUIY-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.14
Rot. Bonds4

About 3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide

3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide (PubChem CID 115674973) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is 3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide.

Molecular Properties

Compound Name3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide
PubChem CID115674973
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide
SMILESCOc1ccc(C(=O)NC(C)C(=O)N2CCCC2)cc1O
InChIInChI=1S/C15H20N2O4/c1-10(15(20)17-7-3-4-8-17)16-14(19)11-5-6-13(21-2)12(18)9-11/h5-6,9-10,18H,3-4,7-8H2,1-2H3,(H,16,19)
InChIKeyHDEVPWIKVCMUIY-UHFFFAOYSA-N
XLogP1.14
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,4,5-trimethoxy-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)benzamide
CID 42702287
1-N,3-N-bis[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]benzene-1,3-dicarboxamide
CID 11090985
3,4-dimethoxy-N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]benzamide
CID 110349066
4-bromo-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 51147959
3,5-dihydroxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 104938945
N-[1-(tert-butylamino)-1-oxopropan-2-yl]-3-hydroxy-4-methoxybenzamide
CID 115674461
N-(1-cyclopentylethyl)-3-hydroxy-4-methoxybenzamide
CID 79672563
3-methyl-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]benzamide
CID 47337226
3-hydroxy-N-(1-hydroxypropan-2-yl)-4-methoxybenzamide
CID 79732831
N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]pyridine-4-carboxamide
CID 110347461
3-chloro-4-iodo-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)benzamide
CID 103735178
2,6-dichloro-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)pyridine-4-carboxamide
CID 115596719

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide?
The IUPAC name of 3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide (CID 115674973) is 3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide.
What is the SMILES notation for 3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide?
The canonical SMILES for 3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide is COc1ccc(C(=O)NC(C)C(=O)N2CCCC2)cc1O.
What is the InChIKey of 3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide?
The InChIKey is HDEVPWIKVCMUIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-10(15(20)17-7-3-4-8-17)16-14(19)11-5-6-13(21-2)12(18)9-11/h5-6,9-10,18H,3-4,7-8H2,1-2H3,(H,16,19).
What are the key properties of 3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide?
3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide has a molecular weight of 292.34 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-4-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzamide is sourced from PubChem (CID 115674973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).