4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide

C15H20N2O2 — CID 2977354

IUPAC4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide
SMILESCc1ccc(C(=O)NCCC(=O)N2CCCC2)cc1
InChIInChI=1S/C15H20N2O2/c1-12-4-6-13(7-5-12)15(19)16-9-8-14(18)17-10-2-3-11-17/h4-7H,2-3,8-11H2,1H3,(H,16,19)
InChIKeyIZPPTPZXOGALAW-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.74
Rot. Bonds4

About 4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide

4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide (PubChem CID 2977354) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide.

Molecular Properties

Compound Name4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide
PubChem CID2977354
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide
SMILESCc1ccc(C(=O)NCCC(=O)N2CCCC2)cc1
InChIInChI=1S/C15H20N2O2/c1-12-4-6-13(7-5-12)15(19)16-9-8-14(18)17-10-2-3-11-17/h4-7H,2-3,8-11H2,1H3,(H,16,19)
InChIKeyIZPPTPZXOGALAW-UHFFFAOYSA-N
XLogP1.74
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide?
The IUPAC name of 4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide (CID 2977354) is 4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide.
What is the SMILES notation for 4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide?
The canonical SMILES for 4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide is Cc1ccc(C(=O)NCCC(=O)N2CCCC2)cc1.
What is the InChIKey of 4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide?
The InChIKey is IZPPTPZXOGALAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-12-4-6-13(7-5-12)15(19)16-9-8-14(18)17-10-2-3-11-17/h4-7H,2-3,8-11H2,1H3,(H,16,19).
What are the key properties of 4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide?
4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide has a molecular weight of 260.34 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide is sourced from PubChem (CID 2977354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).