N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide

C11H19NO2 — CID 130361058

IUPACN-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide
SMILESCON(C)C(=O)C12CCC(CC1)CC2
InChIInChI=1S/C11H19NO2/c1-12(14-2)10(13)11-6-3-9(4-7-11)5-8-11/h9H,3-8H2,1-2H3
InChIKeyFENZPOYQZPFZCC-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.98
Rot. Bonds2

About N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide

N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide (PubChem CID 130361058) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide.

Molecular Properties

Compound NameN-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide
PubChem CID130361058
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC NameN-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide
SMILESCON(C)C(=O)C12CCC(CC1)CC2
InChIInChI=1S/C11H19NO2/c1-12(14-2)10(13)11-6-3-9(4-7-11)5-8-11/h9H,3-8H2,1-2H3
InChIKeyFENZPOYQZPFZCC-UHFFFAOYSA-N
XLogP1.98
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-cyclopropyl-N-methoxy-N-methylcyclopropane-1-carboxamide
CID 137408252
N-methoxy-N-methyl-1-azabicyclo[2.2.1]heptane-4-carboxamide
CID 15663618
tert-butyl 4-[methoxy(methyl)carbamoyl]-2-azabicyclo[2.2.2]octane-2-carboxylate
CID 169066755
1-amino-N-methoxy-N-methylcyclopropane-1-carboxamide
CID 65464735
N-methoxy-N-methyl-4-phenylbicyclo[2.2.2]octane-1-carboxamide
CID 59379799
N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide
CID 89246188
N-methoxy-N-methyl-1-methylsulfanylcyclopropane-1-carboxamide
CID 131206795
N-methoxy-N,3-dimethylazetidine-3-carboxamide
CID 130808649
N-methoxy-N-methyl-1-azabicyclo[3.2.1]octane-5-carboxamide
CID 15663616
3-acetylbicyclo[1.1.1]pentane-1-carbonyl chloride;3-acetyl-N-methoxy-N-methylbicyclo[1.1.1]pentane-1-carboxamide
CID 158630656
tert-butyl 1-[methoxy(methyl)carbamoyl]-3-azabicyclo[3.1.1]heptane-3-carboxylate
CID 169066779
4-amino-N-methoxy-N-methyloxane-4-carboxamide
CID 115294673

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide?
The IUPAC name of N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide (CID 130361058) is N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide.
What is the SMILES notation for N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide?
The canonical SMILES for N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide is CON(C)C(=O)C12CCC(CC1)CC2.
What is the InChIKey of N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide?
The InChIKey is FENZPOYQZPFZCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-12(14-2)10(13)11-6-3-9(4-7-11)5-8-11/h9H,3-8H2,1-2H3.
What are the key properties of N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide?
N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide has a molecular weight of 197.28 g/mol, XLogP of 1.98, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methylbicyclo[2.2.2]octane-1-carboxamide is sourced from PubChem (CID 130361058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).