4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide

C15H27NO4 — CID 157185974

IUPAC4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide
SMILESCCC1CCC(C(=O)NCCOCCOCC=O)CC1
InChIInChI=1S/C15H27NO4/c1-2-13-3-5-14(6-4-13)15(18)16-7-9-19-11-12-20-10-8-17/h8,13-14H,2-7,9-12H2,1H3,(H,16,18)
InChIKeyAPCVKRSINRRGLA-UHFFFAOYSA-N
MW285.38 g/mol
LogP1.55
Rot. Bonds10

About 4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide

4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide (PubChem CID 157185974) has the molecular formula C15H27NO4 and a molecular weight of 285.38 g/mol. Its IUPAC name is 4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide
PubChem CID157185974
Molecular FormulaC15H27NO4
Molecular Weight285.38 g/mol
Exact Mass285.19
IUPAC Name4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide
SMILESCCC1CCC(C(=O)NCCOCCOCC=O)CC1
InChIInChI=1S/C15H27NO4/c1-2-13-3-5-14(6-4-13)15(18)16-7-9-19-11-12-20-10-8-17/h8,13-14H,2-7,9-12H2,1H3,(H,16,18)
InChIKeyAPCVKRSINRRGLA-UHFFFAOYSA-N
XLogP1.55
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.38
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide
CID 163401026
4-(aminomethyl)-N-[2-(2-methoxyethoxy)ethyl]cyclohexane-1-carboxamide
CID 62806612
ethane;N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-methylcyclohexane-1-carboxamide
CID 177357452
N-[2-(2-aminoethoxy)ethyl]-4-butylcyclohexane-1-carboxamide
CID 63754103
2-butoxy-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]acetamide
CID 172626027
4-amino-N-[2-(cyclopropylmethoxy)ethyl]cyclohexane-1-carboxamide
CID 103795970
3-amino-N-[2-(2-methoxyethoxy)ethyl]cyclopentane-1-carboxamide
CID 66009424
N-[2-[(3-ethylcyclopentyl)amino]ethyl]cyclopropanecarboxamide
CID 115651444
4-(aminomethyl)-N-[(4-ethylcyclohexyl)methyl]cyclohexane-1-carboxamide
CID 62807115
N-[2-[2-[2-(cyclopentylamino)ethoxy]ethoxy]ethyl]cyclopentanecarboxamide
CID 166816681
4-amino-N-[2-(2-methylpropoxy)ethyl]cyclohexane-1-carboxamide
CID 113264018
4-N-(4,4-dimethylpent-2-enyl)-1-N-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]cyclohexane-1,4-dicarboxamide
CID 166497234

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide?
The IUPAC name of 4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide (CID 157185974) is 4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide?
The canonical SMILES for 4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide is CCC1CCC(C(=O)NCCOCCOCC=O)CC1.
What is the InChIKey of 4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide?
The InChIKey is APCVKRSINRRGLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO4/c1-2-13-3-5-14(6-4-13)15(18)16-7-9-19-11-12-20-10-8-17/h8,13-14H,2-7,9-12H2,1H3,(H,16,18).
What are the key properties of 4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide?
4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide has a molecular weight of 285.38 g/mol, XLogP of 1.55, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 157185974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).