N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide

C9H17N3O3 — CID 115665185

IUPACN-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide
SMILESCC(CC(N)=O)NC(=O)N1CCOCC1
InChIInChI=1S/C9H17N3O3/c1-7(6-8(10)13)11-9(14)12-2-4-15-5-3-12/h7H,2-6H2,1H3,(H2,10,13)(H,11,14)
InChIKeyFGSFLWFZUOXDFI-UHFFFAOYSA-N
MW215.25 g/mol
LogP-0.71
Rot. Bonds3

About N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide

N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide (PubChem CID 115665185) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide
PubChem CID115665185
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC NameN-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide
SMILESCC(CC(N)=O)NC(=O)N1CCOCC1
InChIInChI=1S/C9H17N3O3/c1-7(6-8(10)13)11-9(14)12-2-4-15-5-3-12/h7H,2-6H2,1H3,(H2,10,13)(H,11,14)
InChIKeyFGSFLWFZUOXDFI-UHFFFAOYSA-N
XLogP-0.71
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-amino-4-oxobutan-2-yl)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

N-(1-cyclopropylpropan-2-yl)morpholine-4-carboxamide
CID 115624308
N-(4-methylsulfanylbutan-2-yl)morpholine-4-carboxamide
CID 115640219
N-(4-amino-4-oxobutan-2-yl)-3-methylpiperidine-1-carboxamide
CID 116657977
N-propan-2-ylmorpholine-4-carboxamide
CID 3411412
N-[(2R)-octan-2-yl]morpholine-4-carboxamide
CID 7815302
(2R)-4-amino-2-(1,4-oxazepane-4-carbonylamino)-4-oxobutanoic acid
CID 107827630
N-(1-amino-3-methylbutan-2-yl)morpholine-4-carboxamide
CID 79155057
N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide
CID 111444624
N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide
CID 106357280
methyl (2S)-3-methyl-2-(morpholine-4-carbonylamino)butanoate
CID 940643
diethyl 2-(morpholine-4-carbonylamino)propanedioate
CID 79151888
N-(2-amino-2-oxoethyl)morpholine-4-carboxamide
CID 115575796

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide?
The IUPAC name of N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide (CID 115665185) is N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide?
The canonical SMILES for N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide is CC(CC(N)=O)NC(=O)N1CCOCC1.
What is the InChIKey of N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide?
The InChIKey is FGSFLWFZUOXDFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-7(6-8(10)13)11-9(14)12-2-4-15-5-3-12/h7H,2-6H2,1H3,(H2,10,13)(H,11,14).
What are the key properties of N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide?
N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide has a molecular weight of 215.25 g/mol, XLogP of -0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 115665185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).