2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide

C11H19NO3 — CID 103020635

IUPAC2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide
SMILESCOC(C)(C)C(=O)NC1CCC(=O)CC1
InChIInChI=1S/C11H19NO3/c1-11(2,15-3)10(14)12-8-4-6-9(13)7-5-8/h8H,4-7H2,1-3H3,(H,12,14)
InChIKeyAYVMBQHBAAHILJ-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.04
Rot. Bonds3

About 2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide

2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide (PubChem CID 103020635) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide.

Molecular Properties

Compound Name2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide
PubChem CID103020635
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide
SMILESCOC(C)(C)C(=O)NC1CCC(=O)CC1
InChIInChI=1S/C11H19NO3/c1-11(2,15-3)10(14)12-8-4-6-9(13)7-5-8/h8H,4-7H2,1-3H3,(H,12,14)
InChIKeyAYVMBQHBAAHILJ-UHFFFAOYSA-N
XLogP1.04
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-difluoro-N-(4-oxocyclohexyl)propanamide
CID 131072178
N-(azepan-4-yl)-2-methoxy-2-methylpropanamide
CID 107172264
1-tert-butyl-3-(4-oxocyclohexyl)urea
CID 43652951
4-tert-butyl-N-(4-oxocyclohexyl)benzamide
CID 43652861
ethyl N-(4-oxocyclohexyl)carbamate
CID 12546192
2-methoxy-2-methyl-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]propanamide
CID 136524347
1-cyclobutyl-3-(4-oxocyclohexyl)urea
CID 116658369
2-cyclopropyl-N-(4-oxocyclohexyl)propanamide
CID 83153733
3,5-dimethyl-N-(4-oxocyclohexyl)benzamide
CID 43652880
N-[(1R)-1-cyclopentylethyl]-2-methoxy-2-methylpropanamide
CID 103029233
1-(2-methoxy-2-methylpropanoyl)piperidin-4-one
CID 103946549
3-methoxy-4-methyl-N-(4-oxocyclohexyl)benzamide
CID 43652834

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide?
The IUPAC name of 2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide (CID 103020635) is 2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide.
What is the SMILES notation for 2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide?
The canonical SMILES for 2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide is COC(C)(C)C(=O)NC1CCC(=O)CC1.
What is the InChIKey of 2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide?
The InChIKey is AYVMBQHBAAHILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-11(2,15-3)10(14)12-8-4-6-9(13)7-5-8/h8H,4-7H2,1-3H3,(H,12,14).
What are the key properties of 2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide?
2-methoxy-2-methyl-N-(4-oxocyclohexyl)propanamide has a molecular weight of 213.28 g/mol, XLogP of 1.04, 3 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-(4-oxocyclohexyl)propanamide is sourced from PubChem (CID 103020635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).