N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide

C19H20N2O4 — CID 17416795

IUPACN-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(N3CCCC3=O)cc2)c1
InChIInChI=1S/C19H20N2O4/c1-24-15-9-10-17(25-2)16(12-15)20-19(23)13-5-7-14(8-6-13)21-11-3-4-18(21)22/h5-10,12H,3-4,11H2,1-2H3,(H,20,23)
InChIKeyBMPQMTPSUAJPPV-UHFFFAOYSA-N
MW340.38 g/mol
LogP3.08
Rot. Bonds5

About N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide

N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 17416795) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide
PubChem CID17416795
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC NameN-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(N3CCCC3=O)cc2)c1
InChIInChI=1S/C19H20N2O4/c1-24-15-9-10-17(25-2)16(12-15)20-19(23)13-5-7-14(8-6-13)21-11-3-4-18(21)22/h5-10,12H,3-4,11H2,1-2H3,(H,20,23)
InChIKeyBMPQMTPSUAJPPV-UHFFFAOYSA-N
XLogP3.08
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide (CID 17416795) is N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide is COc1ccc(OC)c(NC(=O)c2ccc(N3CCCC3=O)cc2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is BMPQMTPSUAJPPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-24-15-9-10-17(25-2)16(12-15)20-19(23)13-5-7-14(8-6-13)21-11-3-4-18(21)22/h5-10,12H,3-4,11H2,1-2H3,(H,20,23).
What are the key properties of N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide?
N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 340.38 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 17416795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).