N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide

C11H20N2O3 — CID 51220547

IUPACN-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide
SMILESCC(C)NC(=O)CNC(=O)C1CCOCC1
InChIInChI=1S/C11H20N2O3/c1-8(2)13-10(14)7-12-11(15)9-3-5-16-6-4-9/h8-9H,3-7H2,1-2H3,(H,12,15)(H,13,14)
InChIKeyXBUYHMYYJXSTJM-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.05
Rot. Bonds4

About N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide

N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide (PubChem CID 51220547) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide
PubChem CID51220547
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide
SMILESCC(C)NC(=O)CNC(=O)C1CCOCC1
InChIInChI=1S/C11H20N2O3/c1-8(2)13-10(14)7-12-11(15)9-3-5-16-6-4-9/h8-9H,3-7H2,1-2H3,(H,12,15)(H,13,14)
InChIKeyXBUYHMYYJXSTJM-UHFFFAOYSA-N
XLogP0.05
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-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-[2-(butan-2-ylamino)-2-oxoethyl]cyclobutanecarboxamide
CID 112990807
3-[[2-oxo-2-(propan-2-ylamino)ethyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 63782619
(1R)-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohex-3-ene-1-carboxamide
CID 27742839
N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]oxane-4-carboxamide
CID 112997122
N-(3-methylbutyl)oxane-4-carboxamide
CID 51110017
N-(2-aminopropyl)oxane-4-carboxamide
CID 15035314
N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]oxane-4-carboxamide
CID 113002379
N-[2-(4-tert-butylanilino)-2-oxoethyl]oxane-4-carboxamide
CID 112997593
N-[2-[[(2S)-1-(dimethylamino)-1-oxopropan-2-yl]amino]-2-oxoethyl]cyclopropanecarboxamide
CID 94191433
N-[2-[4-(diethylamino)anilino]-2-oxoethyl]oxane-4-carboxamide
CID 113000138
N-(1-chloropropan-2-yl)oxane-4-carboxamide
CID 114299496
2-amino-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopropane-1-carboxamide
CID 114995560

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide?
The IUPAC name of N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide (CID 51220547) is N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide.
What is the SMILES notation for N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide?
The canonical SMILES for N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide is CC(C)NC(=O)CNC(=O)C1CCOCC1.
What is the InChIKey of N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide?
The InChIKey is XBUYHMYYJXSTJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-8(2)13-10(14)7-12-11(15)9-3-5-16-6-4-9/h8-9H,3-7H2,1-2H3,(H,12,15)(H,13,14).
What are the key properties of N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide?
N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide has a molecular weight of 228.29 g/mol, XLogP of 0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide is sourced from PubChem (CID 51220547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).