(2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide

C13H24N2O2 — CID 135828034

IUPAC(2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide
SMILESCC[C@H](C(N)=O)N1C[C@H](CC(C)(C)C)CC1=O
InChIInChI=1S/C13H24N2O2/c1-5-10(12(14)17)15-8-9(6-11(15)16)7-13(2,3)4/h9-10H,5-8H2,1-4H3,(H2,14,17)/t9-,10+/m0/s1
InChIKeyOAWBNDBXEGMTMK-VHSXEESVSA-N
MW240.35 g/mol
LogP1.53
Rot. Bonds4

About (2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide

(2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide (PubChem CID 135828034) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is (2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide.

Molecular Properties

Compound Name(2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide
PubChem CID135828034
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name(2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide
SMILESCC[C@H](C(N)=O)N1C[C@H](CC(C)(C)C)CC1=O
InChIInChI=1S/C13H24N2O2/c1-5-10(12(14)17)15-8-9(6-11(15)16)7-13(2,3)4/h9-10H,5-8H2,1-4H3,(H2,14,17)/t9-,10+/m0/s1
InChIKeyOAWBNDBXEGMTMK-VHSXEESVSA-N
XLogP1.53
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-[(4R)-4-(2,2-dideuteriopropyl)-2-oxopyrrolidin-1-yl]butanamide
CID 122551749
(2S)-2-[(4S)-4-(1,1,2,2,3,3,3-heptadeuteriopropyl)-2-oxopyrrolidin-1-yl]butanamide
CID 166174604
[1-[(2S)-1-amino-1-oxobutan-2-yl]-5-oxopyrrolidin-3-yl]methyl thiocyanate
CID 141264581
(2S)-2-[(4S)-2-oxo-4-(trifluoromethyl)pyrrolidin-1-yl]butanamide
CID 11299382
2-[4-(2-amino-1,1,2-trihydroxypropyl)-2-oxopyrrolidin-1-yl]butanamide
CID 91489626
tert-butyl 2-[4-(hydroxymethyl)-2-oxopyrrolidin-1-yl]butanoate
CID 22387022
(2R)-2-[4-[[(2-bromoacetyl)amino]methyl]-2-oxopyrrolidin-1-yl]butanamide
CID 59400524
(2S)-2-[4-(iodomethyl)-2-oxopyrrolidin-1-yl]butanamide;(2S)-2-(3-methyl-5-oxo-2H-pyrrol-1-yl)butanamide
CID 159210796
2-[4-[2-[(2-bromoacetyl)-methylamino]ethyl]-2-oxopyrrolidin-1-yl]butanamide
CID 75167803
N'-[[1-[(2R)-1-amino-1-oxobutan-2-yl]-5-oxopyrrolidin-3-yl]methyl]-N-(cyclooctadecylmethyl)butanediamide
CID 166955858
N'-[[1-[(2R)-1-amino-1-oxobutan-2-yl]-5-oxopyrrolidin-3-yl]methyl]-N-methylbutanediamide;cyclooctadecane
CID 167542037
2-(4-hexyl-2-oxopyrrolidin-1-yl)octanamide
CID 22387164

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide?
The IUPAC name of (2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide (CID 135828034) is (2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide.
What is the SMILES notation for (2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide?
The canonical SMILES for (2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide is CC[C@H](C(N)=O)N1C[C@H](CC(C)(C)C)CC1=O.
What is the InChIKey of (2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide?
The InChIKey is OAWBNDBXEGMTMK-VHSXEESVSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-5-10(12(14)17)15-8-9(6-11(15)16)7-13(2,3)4/h9-10H,5-8H2,1-4H3,(H2,14,17)/t9-,10+/m0/s1.
What are the key properties of (2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide?
(2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide has a molecular weight of 240.35 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(4R)-4-(2,2-dimethylpropyl)-2-oxopyrrolidin-1-yl]butanamide is sourced from PubChem (CID 135828034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).