N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide

C10H18N2O2 — CID 83192944

IUPACN-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide
SMILESCCC(C)CNC(=O)C1CNC(=O)C1
InChIInChI=1S/C10H18N2O2/c1-3-7(2)5-12-10(14)8-4-9(13)11-6-8/h7-8H,3-6H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyLWWUROASLYPBFP-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.28
Rot. Bonds4

About N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide

N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 83192944) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID83192944
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC NameN-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide
SMILESCCC(C)CNC(=O)C1CNC(=O)C1
InChIInChI=1S/C10H18N2O2/c1-3-7(2)5-12-10(14)8-4-9(13)11-6-8/h7-8H,3-6H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyLWWUROASLYPBFP-UHFFFAOYSA-N
XLogP0.28
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylbutyl)-5-oxopyrrolidine-3-carboxamide
CID 115613116
N-(3-methoxy-2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 78983025
N-[2-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxamide
CID 78983231
N-(2-amino-3-methylbutyl)-5-oxopyrrolidine-3-carboxamide
CID 81486208
N-(2-methylsulfinylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 115764461
5-oxo-N-(2,2,3-trimethylbutyl)pyrrolidine-3-carboxamide
CID 102610483
N-[(2R)-2-hydroxypropyl]-6-oxopiperidine-3-carboxamide
CID 103884751
N-[2-(diethylamino)-2-oxoethyl]-5-oxopyrrolidine-3-carboxamide
CID 113228049
N-(2-ethyl-2-hydroxybutyl)-5-oxopyrrolidine-3-carboxamide
CID 79039925
2-methyl-3-[(6-oxopiperidine-3-carbonyl)amino]propanoic acid
CID 83192791
N-(2-ethoxypropyl)-6-oxopiperidine-3-carboxamide
CID 115649057
N-(2-aminoethyl)-5-oxopyrrolidine-3-carboxamide
CID 81459469

Frequently Asked Questions

What is the IUPAC name of N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide (CID 83192944) is N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide is CCC(C)CNC(=O)C1CNC(=O)C1.
What is the InChIKey of N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is LWWUROASLYPBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-3-7(2)5-12-10(14)8-4-9(13)11-6-8/h7-8H,3-6H2,1-2H3,(H,11,13)(H,12,14).
What are the key properties of N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide?
N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 198.27 g/mol, XLogP of 0.28, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylbutyl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 83192944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).