N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide

C11H20N2O3 — CID 79152144

IUPACN-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide
SMILESCC(C)(C)C(=O)CNC(=O)N1CCOCC1
InChIInChI=1S/C11H20N2O3/c1-11(2,3)9(14)8-12-10(15)13-4-6-16-7-5-13/h4-8H2,1-3H3,(H,12,15)
InChIKeyDKPMLWLBDQNGSO-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.64
Rot. Bonds2

About N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide

N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide (PubChem CID 79152144) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide
PubChem CID79152144
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide
SMILESCC(C)(C)C(=O)CNC(=O)N1CCOCC1
InChIInChI=1S/C11H20N2O3/c1-11(2,3)9(14)8-12-10(15)13-4-6-16-7-5-13/h4-8H2,1-3H3,(H,12,15)
InChIKeyDKPMLWLBDQNGSO-UHFFFAOYSA-N
XLogP0.64
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(morpholine-4-carbonylamino)acetic acid
CID 18917961
N-[2-(methylamino)-2-oxoethyl]morpholine-4-carboxamide
CID 115575285
N-(2-amino-2-oxoethyl)morpholine-4-carboxamide
CID 115575796
N-(3-methyl-2-oxobutyl)morpholine-4-carboxamide
CID 79152408
2-hydroxy-2-methyl-3-(morpholine-4-carbonylamino)propanoic acid
CID 66173250
N-propylmorpholine-4-carboxamide
CID 3410822
2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide
CID 47009992
N-(4-hydroxy-2,2-dimethylbutyl)morpholine-4-carboxamide
CID 103713760
N-[2-[(S)-tert-butylsulfinyl]ethyl]morpholine-4-carboxamide
CID 96502385
N-[(2S)-2-hydroxypropyl]morpholine-4-carboxamide
CID 83039783
N-(5-hydroxy-2,2-dimethylpentyl)morpholine-4-carboxamide
CID 103896247
4,4-dimethyl-2-[(morpholine-4-carbonylamino)methyl]pentanoic acid
CID 107473765

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide?
The IUPAC name of N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide (CID 79152144) is N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide?
The canonical SMILES for N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide is CC(C)(C)C(=O)CNC(=O)N1CCOCC1.
What is the InChIKey of N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide?
The InChIKey is DKPMLWLBDQNGSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-11(2,3)9(14)8-12-10(15)13-4-6-16-7-5-13/h4-8H2,1-3H3,(H,12,15).
What are the key properties of N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide?
N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide has a molecular weight of 228.29 g/mol, XLogP of 0.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide is sourced from PubChem (CID 79152144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).