4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one

C10H19NO2 — CID 79120255

IUPAC4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one
SMILESCOCCN(C)C1CCC(=O)CC1
InChIInChI=1S/C10H19NO2/c1-11(7-8-13-2)9-3-5-10(12)6-4-9/h9H,3-8H2,1-2H3
InChIKeyNFVOPNSGIGYEEA-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.08
Rot. Bonds4

About 4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one

4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one (PubChem CID 79120255) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one.

Molecular Properties

Compound Name4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one
PubChem CID79120255
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one
SMILESCOCCN(C)C1CCC(=O)CC1
InChIInChI=1S/C10H19NO2/c1-11(7-8-13-2)9-3-5-10(12)6-4-9/h9H,3-8H2,1-2H3
InChIKeyNFVOPNSGIGYEEA-UHFFFAOYSA-N
XLogP1.08
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one?
The IUPAC name of 4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one (CID 79120255) is 4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one.
What is the SMILES notation for 4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one?
The canonical SMILES for 4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one is COCCN(C)C1CCC(=O)CC1.
What is the InChIKey of 4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one?
The InChIKey is NFVOPNSGIGYEEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-11(7-8-13-2)9-3-5-10(12)6-4-9/h9H,3-8H2,1-2H3.
What are the key properties of 4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one?
4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one has a molecular weight of 185.27 g/mol, XLogP of 1.08, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-methoxyethyl(methyl)amino]cyclohexan-1-one is sourced from PubChem (CID 79120255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).