N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide

C14H26N2O2 — CID 58033910

IUPACN-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide
SMILESCC(C)CC(C(=O)NC(C)(C)C)N1CCCC1=O
InChIInChI=1S/C14H26N2O2/c1-10(2)9-11(13(18)15-14(3,4)5)16-8-6-7-12(16)17/h10-11H,6-9H2,1-5H3,(H,15,18)
InChIKeyXFSSYIVZCYCFPW-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.94
Rot. Bonds4

About N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide

N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide (PubChem CID 58033910) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide.

Molecular Properties

Compound NameN-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide
PubChem CID58033910
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide
SMILESCC(C)CC(C(=O)NC(C)(C)C)N1CCCC1=O
InChIInChI=1S/C14H26N2O2/c1-10(2)9-11(13(18)15-14(3,4)5)16-8-6-7-12(16)17/h10-11H,6-9H2,1-5H3,(H,15,18)
InChIKeyXFSSYIVZCYCFPW-UHFFFAOYSA-N
XLogP1.94
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide?
The IUPAC name of N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide (CID 58033910) is N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide.
What is the SMILES notation for N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide?
The canonical SMILES for N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide is CC(C)CC(C(=O)NC(C)(C)C)N1CCCC1=O.
What is the InChIKey of N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide?
The InChIKey is XFSSYIVZCYCFPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-10(2)9-11(13(18)15-14(3,4)5)16-8-6-7-12(16)17/h10-11H,6-9H2,1-5H3,(H,15,18).
What are the key properties of N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide?
N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide has a molecular weight of 254.37 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-4-methyl-2-(2-oxopyrrolidin-1-yl)pentanamide is sourced from PubChem (CID 58033910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).