N-(cyclohexen-1-yl)acetamide

C8H13NO — CID 13169239

IUPACN-(cyclohexen-1-yl)acetamide
SMILESCC(=O)NC1=CCCCC1
InChIInChI=1S/C8H13NO/c1-7(10)9-8-5-3-2-4-6-8/h5H,2-4,6H2,1H3,(H,9,10)
InChIKeyRKDAPIXTZRTFKL-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.58
Rot. Bonds1

About N-(cyclohexen-1-yl)acetamide

N-(cyclohexen-1-yl)acetamide (PubChem CID 13169239) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is N-(cyclohexen-1-yl)acetamide.

Molecular Properties

Compound NameN-(cyclohexen-1-yl)acetamide
PubChem CID13169239
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC NameN-(cyclohexen-1-yl)acetamide
SMILESCC(=O)NC1=CCCCC1
InChIInChI=1S/C8H13NO/c1-7(10)9-8-5-3-2-4-6-8/h5H,2-4,6H2,1H3,(H,9,10)
InChIKeyRKDAPIXTZRTFKL-UHFFFAOYSA-N
XLogP1.58
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexen-1-yl)acetamide?
The IUPAC name of N-(cyclohexen-1-yl)acetamide (CID 13169239) is N-(cyclohexen-1-yl)acetamide.
What is the SMILES notation for N-(cyclohexen-1-yl)acetamide?
The canonical SMILES for N-(cyclohexen-1-yl)acetamide is CC(=O)NC1=CCCCC1.
What is the InChIKey of N-(cyclohexen-1-yl)acetamide?
The InChIKey is RKDAPIXTZRTFKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-7(10)9-8-5-3-2-4-6-8/h5H,2-4,6H2,1H3,(H,9,10).
What are the key properties of N-(cyclohexen-1-yl)acetamide?
N-(cyclohexen-1-yl)acetamide has a molecular weight of 139.20 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexen-1-yl)acetamide is sourced from PubChem (CID 13169239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).