N-(2-cyclohex-3-en-1-yloxyethyl)acetamide

C10H17NO2 — CID 70596832

IUPACN-(2-cyclohex-3-en-1-yloxyethyl)acetamide
SMILESCC(=O)NCCOC1CC=CCC1
InChIInChI=1S/C10H17NO2/c1-9(12)11-7-8-13-10-5-3-2-4-6-10/h2-3,10H,4-8H2,1H3,(H,11,12)
InChIKeyCWDJPFLVUZMZQC-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.25
Rot. Bonds4

About N-(2-cyclohex-3-en-1-yloxyethyl)acetamide

N-(2-cyclohex-3-en-1-yloxyethyl)acetamide (PubChem CID 70596832) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is N-(2-cyclohex-3-en-1-yloxyethyl)acetamide.

Molecular Properties

Compound NameN-(2-cyclohex-3-en-1-yloxyethyl)acetamide
PubChem CID70596832
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC NameN-(2-cyclohex-3-en-1-yloxyethyl)acetamide
SMILESCC(=O)NCCOC1CC=CCC1
InChIInChI=1S/C10H17NO2/c1-9(12)11-7-8-13-10-5-3-2-4-6-10/h2-3,10H,4-8H2,1H3,(H,11,12)
InChIKeyCWDJPFLVUZMZQC-UHFFFAOYSA-N
XLogP1.25
TPSA38.33 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 ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohex-3-en-1-yloxyethyl)acetamide?
The IUPAC name of N-(2-cyclohex-3-en-1-yloxyethyl)acetamide (CID 70596832) is N-(2-cyclohex-3-en-1-yloxyethyl)acetamide.
What is the SMILES notation for N-(2-cyclohex-3-en-1-yloxyethyl)acetamide?
The canonical SMILES for N-(2-cyclohex-3-en-1-yloxyethyl)acetamide is CC(=O)NCCOC1CC=CCC1.
What is the InChIKey of N-(2-cyclohex-3-en-1-yloxyethyl)acetamide?
The InChIKey is CWDJPFLVUZMZQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-9(12)11-7-8-13-10-5-3-2-4-6-10/h2-3,10H,4-8H2,1H3,(H,11,12).
What are the key properties of N-(2-cyclohex-3-en-1-yloxyethyl)acetamide?
N-(2-cyclohex-3-en-1-yloxyethyl)acetamide has a molecular weight of 183.25 g/mol, XLogP of 1.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohex-3-en-1-yloxyethyl)acetamide is sourced from PubChem (CID 70596832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).