N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide

C24H30N2O5 — CID 55657151

IUPACN-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide
SMILESCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCC3=O)c2)cc1OCCC
InChIInChI=1S/C24H30N2O5/c1-4-13-30-21-10-8-17(15-22(21)31-14-5-2)24(28)25-18-9-11-20(29-3)19(16-18)26-12-6-7-23(26)27/h8-11,15-16H,4-7,12-14H2,1-3H3,(H,25,28)
InChIKeyCVRFRZPPECGTBP-UHFFFAOYSA-N
MW426.51 g/mol
LogP4.65
Rot. Bonds10

About N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide

N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide (PubChem CID 55657151) has the molecular formula C24H30N2O5 and a molecular weight of 426.51 g/mol. Its IUPAC name is N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide.

Molecular Properties

Compound NameN-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide
PubChem CID55657151
Molecular FormulaC24H30N2O5
Molecular Weight426.51 g/mol
Exact Mass426.22
IUPAC NameN-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide
SMILESCCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCC3=O)c2)cc1OCCC
InChIInChI=1S/C24H30N2O5/c1-4-13-30-21-10-8-17(15-22(21)31-14-5-2)24(28)25-18-9-11-20(29-3)19(16-18)26-12-6-7-23(26)27/h8-11,15-16H,4-7,12-14H2,1-3H3,(H,25,28)
InChIKeyCVRFRZPPECGTBP-UHFFFAOYSA-N
XLogP4.65
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.51
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-diethoxy-N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687515
3,4-dichloro-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7687099
3,5-dimethoxy-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7687052
2-butyl-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-1,3-dioxoisoindole-5-carboxamide
CID 35386053
4-bromo-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687877
N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,5-bis(trifluoromethyl)benzamide
CID 35389984
N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3-methyl-4-nitrobenzamide
CID 7687075
N-(3,4-dipropoxyphenyl)-3-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 9376524
N-(3-amino-4-methoxyphenyl)-3,4-dipropoxybenzamide
CID 119420223
N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dimethylbenzamide
CID 7686708
N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]pyridine-3-carboxamide
CID 35390097
N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]-3H-benzimidazole-5-carboxamide
CID 92862558

Frequently Asked Questions

What is the IUPAC name of N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide?
The IUPAC name of N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide (CID 55657151) is N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide.
What is the SMILES notation for N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide?
The canonical SMILES for N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide is CCCOc1ccc(C(=O)Nc2ccc(OC)c(N3CCCC3=O)c2)cc1OCCC.
What is the InChIKey of N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide?
The InChIKey is CVRFRZPPECGTBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O5/c1-4-13-30-21-10-8-17(15-22(21)31-14-5-2)24(28)25-18-9-11-20(29-3)19(16-18)26-12-6-7-23(26)27/h8-11,15-16H,4-7,12-14H2,1-3H3,(H,25,28).
What are the key properties of N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide?
N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide has a molecular weight of 426.51 g/mol, XLogP of 4.65, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dipropoxybenzamide is sourced from PubChem (CID 55657151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).