2-[2-(2-oxoethyl)cyclohexyl]acetamide

C10H17NO2 — CID 87760374

IUPAC2-[2-(2-oxoethyl)cyclohexyl]acetamide
SMILESNC(=O)CC1CCCCC1CC=O
InChIInChI=1S/C10H17NO2/c11-10(13)7-9-4-2-1-3-8(9)5-6-12/h6,8-9H,1-5,7H2,(H2,11,13)
InChIKeyQIZFXTBPDTVMJA-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.26
Rot. Bonds4

About 2-[2-(2-oxoethyl)cyclohexyl]acetamide

2-[2-(2-oxoethyl)cyclohexyl]acetamide (PubChem CID 87760374) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-[2-(2-oxoethyl)cyclohexyl]acetamide.

Molecular Properties

Compound Name2-[2-(2-oxoethyl)cyclohexyl]acetamide
PubChem CID87760374
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name2-[2-(2-oxoethyl)cyclohexyl]acetamide
SMILESNC(=O)CC1CCCCC1CC=O
InChIInChI=1S/C10H17NO2/c11-10(13)7-9-4-2-1-3-8(9)5-6-12/h6,8-9H,1-5,7H2,(H2,11,13)
InChIKeyQIZFXTBPDTVMJA-UHFFFAOYSA-N
XLogP1.26
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-[(1S,2S)-2-hydroxycyclohexyl]acetamide
CID 93495946
2-cyclodecylacetamide
CID 150110792
2-(2-bromocycloheptyl)acetaldehyde
CID 87725646
2-(2-oxoethyl)bicyclo[1.1.1]pentane-1-carboxamide
CID 175866815
tert-butyl 2-(2-oxoethyl)cyclohexane-1-carboxylate
CID 21479100
[2-(2-oxoethyl)cyclohexyl] nitrate
CID 173397282
ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde
CID 143647546
2-[(1S,2R)-2-methylcyclopropyl]acetamide
CID 93476800
2-(2-sulfanylpiperidin-3-yl)acetamide
CID 155432004
4-(2-oxoethyl)cyclohexane-1-carboxamide
CID 87477686
2-[(2S)-piperidin-1-ium-2-yl]acetamide
CID 7298460
2-(2-oxoethyl)cyclopropane-1-carboxylic acid
CID 91091325

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-oxoethyl)cyclohexyl]acetamide?
The IUPAC name of 2-[2-(2-oxoethyl)cyclohexyl]acetamide (CID 87760374) is 2-[2-(2-oxoethyl)cyclohexyl]acetamide.
What is the SMILES notation for 2-[2-(2-oxoethyl)cyclohexyl]acetamide?
The canonical SMILES for 2-[2-(2-oxoethyl)cyclohexyl]acetamide is NC(=O)CC1CCCCC1CC=O.
What is the InChIKey of 2-[2-(2-oxoethyl)cyclohexyl]acetamide?
The InChIKey is QIZFXTBPDTVMJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c11-10(13)7-9-4-2-1-3-8(9)5-6-12/h6,8-9H,1-5,7H2,(H2,11,13).
What are the key properties of 2-[2-(2-oxoethyl)cyclohexyl]acetamide?
2-[2-(2-oxoethyl)cyclohexyl]acetamide has a molecular weight of 183.25 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-oxoethyl)cyclohexyl]acetamide is sourced from PubChem (CID 87760374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).