2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide

C16H27NO2 — CID 63563657

IUPAC2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide
SMILESO=C(CC1=CCCCC1)N(CCO)C1CCCCC1
InChIInChI=1S/C16H27NO2/c18-12-11-17(15-9-5-2-6-10-15)16(19)13-14-7-3-1-4-8-14/h7,15,18H,1-6,8-13H2
InChIKeyCZMXUDYRZTTXER-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.03
Rot. Bonds5

About 2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide

2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide (PubChem CID 63563657) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide
PubChem CID63563657
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide
SMILESO=C(CC1=CCCCC1)N(CCO)C1CCCCC1
InChIInChI=1S/C16H27NO2/c18-12-11-17(15-9-5-2-6-10-15)16(19)13-14-7-3-1-4-8-14/h7,15,18H,1-6,8-13H2
InChIKeyCZMXUDYRZTTXER-UHFFFAOYSA-N
XLogP3.03
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide (CID 63563657) is 2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide is O=C(CC1=CCCCC1)N(CCO)C1CCCCC1.
What is the InChIKey of 2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide?
The InChIKey is CZMXUDYRZTTXER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c18-12-11-17(15-9-5-2-6-10-15)16(19)13-14-7-3-1-4-8-14/h7,15,18H,1-6,8-13H2.
What are the key properties of 2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide?
2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide has a molecular weight of 265.40 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 2-(cyclohexen-1-yl)-N-cyclohexyl-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 63563657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).