N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide

C15H27NO2 — CID 140689700

IUPACN-(2-cyclohexyloxyethyl)cyclohexanecarboxamide
SMILESO=C(NCCOC1CCCCC1)C1CCCCC1
InChIInChI=1S/C15H27NO2/c17-15(13-7-3-1-4-8-13)16-11-12-18-14-9-5-2-6-10-14/h13-14H,1-12H2,(H,16,17)
InChIKeyWQEHVMOFGVEVKA-UHFFFAOYSA-N
MW253.39 g/mol
LogP3.03
Rot. Bonds5

About N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide

N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide (PubChem CID 140689700) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(2-cyclohexyloxyethyl)cyclohexanecarboxamide
PubChem CID140689700
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC NameN-(2-cyclohexyloxyethyl)cyclohexanecarboxamide
SMILESO=C(NCCOC1CCCCC1)C1CCCCC1
InChIInChI=1S/C15H27NO2/c17-15(13-7-3-1-4-8-13)16-11-12-18-14-9-5-2-6-10-14/h13-14H,1-12H2,(H,16,17)
InChIKeyWQEHVMOFGVEVKA-UHFFFAOYSA-N
XLogP3.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide?
The IUPAC name of N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide (CID 140689700) is N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide.
What is the SMILES notation for N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide?
The canonical SMILES for N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide is O=C(NCCOC1CCCCC1)C1CCCCC1.
What is the InChIKey of N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide?
The InChIKey is WQEHVMOFGVEVKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c17-15(13-7-3-1-4-8-13)16-11-12-18-14-9-5-2-6-10-14/h13-14H,1-12H2,(H,16,17).
What are the key properties of N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide?
N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide has a molecular weight of 253.39 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyloxyethyl)cyclohexanecarboxamide is sourced from PubChem (CID 140689700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).