N,N-dimethyl-2-(4-oxocyclohexyl)acetamide

C10H17NO2 — CID 59442836

IUPACN,N-dimethyl-2-(4-oxocyclohexyl)acetamide
SMILESCN(C)C(=O)CC1CCC(=O)CC1
InChIInChI=1S/C10H17NO2/c1-11(2)10(13)7-8-3-5-9(12)6-4-8/h8H,3-7H2,1-2H3
InChIKeyZQWQJKYZTHWHGX-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.22
Rot. Bonds2

About N,N-dimethyl-2-(4-oxocyclohexyl)acetamide

N,N-dimethyl-2-(4-oxocyclohexyl)acetamide (PubChem CID 59442836) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is N,N-dimethyl-2-(4-oxocyclohexyl)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(4-oxocyclohexyl)acetamide
PubChem CID59442836
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC NameN,N-dimethyl-2-(4-oxocyclohexyl)acetamide
SMILESCN(C)C(=O)CC1CCC(=O)CC1
InChIInChI=1S/C10H17NO2/c1-11(2)10(13)7-8-3-5-9(12)6-4-8/h8H,3-7H2,1-2H3
InChIKeyZQWQJKYZTHWHGX-UHFFFAOYSA-N
XLogP1.22
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-((Dimethylamino)methyl)cyclohexanone
CID 85838
Cyclohexanecarboxamide, N,N-dipropyl-
CID 152793
Cyclohexanecarboxamide, N,N-diethyl-
CID 94872
N,N-Diethylcyclohexanepropanamide
CID 95064
N,N-Diethylcyclohexaneacetamide
CID 125722
N,N-Dimethylcyclohexanecarboxamide
CID 567668
Cyclohexanecarboxamide, N,N-dibutyl-
CID 533209
N,N,N-trimethyl(2-oxocyclohexyl)methanaminium
CID 359484
N,N-dimethyl-4-oxocyclohexane-1-carboxamide
CID 68003587
N,N,2-trimethyloctanamide
CID 87943776
2-Cyclohexyl-N,N-dimethylacetamide
CID 12760890
Cyclohexane-1,4-cis-dicarboxamide, N,N,N',N'-tetramethyl-
CID 551854

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(4-oxocyclohexyl)acetamide?
The IUPAC name of N,N-dimethyl-2-(4-oxocyclohexyl)acetamide (CID 59442836) is N,N-dimethyl-2-(4-oxocyclohexyl)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(4-oxocyclohexyl)acetamide?
The canonical SMILES for N,N-dimethyl-2-(4-oxocyclohexyl)acetamide is CN(C)C(=O)CC1CCC(=O)CC1.
What is the InChIKey of N,N-dimethyl-2-(4-oxocyclohexyl)acetamide?
The InChIKey is ZQWQJKYZTHWHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-11(2)10(13)7-8-3-5-9(12)6-4-8/h8H,3-7H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(4-oxocyclohexyl)acetamide?
N,N-dimethyl-2-(4-oxocyclohexyl)acetamide has a molecular weight of 183.25 g/mol, XLogP of 1.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(4-oxocyclohexyl)acetamide is sourced from PubChem (CID 59442836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).