N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide

C13H25NO3 — CID 60668714

IUPACN-(3-cyclohexyloxypropyl)-2-ethoxyacetamide
SMILESCCOCC(=O)NCCCOC1CCCCC1
InChIInChI=1S/C13H25NO3/c1-2-16-11-13(15)14-9-6-10-17-12-7-4-3-5-8-12/h12H,2-11H2,1H3,(H,14,15)
InChIKeyKKDZJFXIUZXMKG-UHFFFAOYSA-N
MW243.35 g/mol
LogP1.88
Rot. Bonds8

About N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide

N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide (PubChem CID 60668714) has the molecular formula C13H25NO3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide.

Molecular Properties

Compound NameN-(3-cyclohexyloxypropyl)-2-ethoxyacetamide
PubChem CID60668714
Molecular FormulaC13H25NO3
Molecular Weight243.35 g/mol
Exact Mass243.18
IUPAC NameN-(3-cyclohexyloxypropyl)-2-ethoxyacetamide
SMILESCCOCC(=O)NCCCOC1CCCCC1
InChIInChI=1S/C13H25NO3/c1-2-16-11-13(15)14-9-6-10-17-12-7-4-3-5-8-12/h12H,2-11H2,1H3,(H,14,15)
InChIKeyKKDZJFXIUZXMKG-UHFFFAOYSA-N
XLogP1.88
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-cyclohexyloxyethyl)-2-ethoxyacetamide
CID 61217692
2-ethoxy-N-(3-piperidin-4-yloxypropyl)acetamide
CID 55252228
3-amino-N-(3-cyclohexyloxypropyl)propanamide
CID 61275390
N-(3-cyclohexyloxypropyl)-2-[cyclopentyl(ethyl)amino]acetamide
CID 87017395
N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide
CID 134030025
N-(3-cyclohexyloxypropyl)-2-(prop-2-ynylamino)acetamide
CID 79286966
5-(3-cyclohexyloxypropylamino)-3-methyl-5-oxopentanoic acid
CID 62964201
2-amino-N-(3-cyclohexyloxypropyl)propanamide
CID 61275790
N-(3-cyclohexyloxypropyl)-2-(1-hydroxycyclopentyl)acetamide
CID 111430333
1-(3-cyclopentyloxypropyl)-3-(4-ethoxybutyl)-2-methylguanidine
CID 111946277
ethyl 7-(3-cyclohexyloxypropylcarbamoylamino)heptanoate
CID 55794353
2-[[(3-cyclohexyloxypropylamino)-(ethylamino)methylidene]amino]-N-ethylacetamide
CID 111398237

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide?
The IUPAC name of N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide (CID 60668714) is N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide.
What is the SMILES notation for N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide?
The canonical SMILES for N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide is CCOCC(=O)NCCCOC1CCCCC1.
What is the InChIKey of N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide?
The InChIKey is KKDZJFXIUZXMKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO3/c1-2-16-11-13(15)14-9-6-10-17-12-7-4-3-5-8-12/h12H,2-11H2,1H3,(H,14,15).
What are the key properties of N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide?
N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide has a molecular weight of 243.35 g/mol, XLogP of 1.88, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide is sourced from PubChem (CID 60668714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).