N-(2,2-dimethoxycyclohexyl)acetamide

C10H19NO3 — CID 130011755

IUPACN-(2,2-dimethoxycyclohexyl)acetamide
SMILESCOC1(OC)CCCCC1NC(C)=O
InChIInChI=1S/C10H19NO3/c1-8(12)11-9-6-4-5-7-10(9,13-2)14-3/h9H,4-7H2,1-3H3,(H,11,12)
InChIKeyRSAQNIJYYXXRTK-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.05
Rot. Bonds3

About N-(2,2-dimethoxycyclohexyl)acetamide

N-(2,2-dimethoxycyclohexyl)acetamide (PubChem CID 130011755) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-(2,2-dimethoxycyclohexyl)acetamide.

Molecular Properties

Compound NameN-(2,2-dimethoxycyclohexyl)acetamide
PubChem CID130011755
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC NameN-(2,2-dimethoxycyclohexyl)acetamide
SMILESCOC1(OC)CCCCC1NC(C)=O
InChIInChI=1S/C10H19NO3/c1-8(12)11-9-6-4-5-7-10(9,13-2)14-3/h9H,4-7H2,1-3H3,(H,11,12)
InChIKeyRSAQNIJYYXXRTK-UHFFFAOYSA-N
XLogP1.05
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze N-(2,2-dimethoxycyclohexyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,2-dimethoxycyclohexyl)-2,3,4,5-tetrafluorobenzamide
CID 126826185
N-(9-aminospiro[4.4]nonan-4-yl)acetamide
CID 121370272
1-hydroperoxy-2-iodo-1-methoxycyclohexane
CID 102160860
N-[(1R,2S)-2-(3,4-dichlorophenyl)-2-(1-methylpyrrolidin-1-ium-1-yl)cyclohexyl]acetamide
CID 88794531
N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide
CID 86769478
N-(8-bicyclo[5.1.0]octanyl)acetamide
CID 130011496
1-(1-methoxycycloheptyl)ethanone
CID 83225564
methyl (1R)-2,2-dimethoxycyclobutane-1-carboxylate
CID 124705910
methyl 1-(cyclohexylamino)cyclohexane-1-carboxylate
CID 54892504
2-cyclopentyl-1-(1-methoxycyclopentyl)ethanone
CID 104610038
tert-butyl N-(2,2-difluorocyclohexyl)carbamate
CID 70317429
N-[4-[(3-nitrophenyl)methyl]-1-oxa-4-azaspiro[5.5]undecan-11-yl]acetamide
CID 131672125

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethoxycyclohexyl)acetamide?
The IUPAC name of N-(2,2-dimethoxycyclohexyl)acetamide (CID 130011755) is N-(2,2-dimethoxycyclohexyl)acetamide.
What is the SMILES notation for N-(2,2-dimethoxycyclohexyl)acetamide?
The canonical SMILES for N-(2,2-dimethoxycyclohexyl)acetamide is COC1(OC)CCCCC1NC(C)=O.
What is the InChIKey of N-(2,2-dimethoxycyclohexyl)acetamide?
The InChIKey is RSAQNIJYYXXRTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-8(12)11-9-6-4-5-7-10(9,13-2)14-3/h9H,4-7H2,1-3H3,(H,11,12).
What are the key properties of N-(2,2-dimethoxycyclohexyl)acetamide?
N-(2,2-dimethoxycyclohexyl)acetamide has a molecular weight of 201.27 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethoxycyclohexyl)acetamide is sourced from PubChem (CID 130011755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).