2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide

C12H23NO3 — CID 103769337

IUPAC2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide
SMILESCOC(C)(C)C(=O)NC(C)C1CCOCC1
InChIInChI=1S/C12H23NO3/c1-9(10-5-7-16-8-6-10)13-11(14)12(2,3)15-4/h9-10H,5-8H2,1-4H3,(H,13,14)
InChIKeyXCJGZSRHYKFNJV-UHFFFAOYSA-N
MW229.32 g/mol
LogP1.34
Rot. Bonds4

About 2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide

2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide (PubChem CID 103769337) has the molecular formula C12H23NO3 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide.

Molecular Properties

Compound Name2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide
PubChem CID103769337
Molecular FormulaC12H23NO3
Molecular Weight229.32 g/mol
Exact Mass229.17
IUPAC Name2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide
SMILESCOC(C)(C)C(=O)NC(C)C1CCOCC1
InChIInChI=1S/C12H23NO3/c1-9(10-5-7-16-8-6-10)13-11(14)12(2,3)15-4/h9-10H,5-8H2,1-4H3,(H,13,14)
InChIKeyXCJGZSRHYKFNJV-UHFFFAOYSA-N
XLogP1.34
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-1-cyclopentylethyl]-2-methoxy-2-methylpropanamide
CID 103029233
N-[(1S)-1-cyclohexylethyl]-2-methoxy-2-methylpropanamide
CID 103029230
4-amino-2,2-dimethyl-N-[1-(oxan-4-yl)ethyl]butanamide
CID 114285687
3-amino-2,2-dimethyl-N-[1-(oxan-4-yl)ethyl]-3-sulfanylidenepropanamide
CID 114115167
2,2,3,3-tetrafluoro-N-[1-(oxan-4-yl)ethyl]propanamide
CID 103769518
2-hydroxy-2-methyl-N-[1-(oxolan-3-yl)ethyl]propanamide
CID 103430535
N-[1-(oxan-4-yl)ethyl]cyclopropanecarboxamide
CID 103769201
2-cyano-2-ethyl-N-[1-(oxan-4-yl)ethyl]butanamide
CID 114115162
2-amino-N-[1-(oxan-4-yl)ethyl]-2-phenylpropanamide;hydrochloride
CID 120593233
2-amino-2-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]propanamide
CID 115753126
3-(tert-butylamino)-N-[1-(oxan-4-yl)ethyl]propanamide
CID 114115155
N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide
CID 103768181

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide?
The IUPAC name of 2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide (CID 103769337) is 2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide.
What is the SMILES notation for 2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide?
The canonical SMILES for 2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide is COC(C)(C)C(=O)NC(C)C1CCOCC1.
What is the InChIKey of 2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide?
The InChIKey is XCJGZSRHYKFNJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3/c1-9(10-5-7-16-8-6-10)13-11(14)12(2,3)15-4/h9-10H,5-8H2,1-4H3,(H,13,14).
What are the key properties of 2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide?
2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide has a molecular weight of 229.32 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyl-N-[1-(oxan-4-yl)ethyl]propanamide is sourced from PubChem (CID 103769337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).