N-(2-phenylcyclohexen-1-yl)acetamide

C14H17NO — CID 24769089

IUPACN-(2-phenylcyclohexen-1-yl)acetamide
SMILESCC(=O)NC1=C(c2ccccc2)CCCC1
InChIInChI=1S/C14H17NO/c1-11(16)15-14-10-6-5-9-13(14)12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-10H2,1H3,(H,15,16)
InChIKeyVNPGMOBYHXPLMS-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.11
Rot. Bonds2

About N-(2-phenylcyclohexen-1-yl)acetamide

N-(2-phenylcyclohexen-1-yl)acetamide (PubChem CID 24769089) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is N-(2-phenylcyclohexen-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-phenylcyclohexen-1-yl)acetamide
PubChem CID24769089
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC NameN-(2-phenylcyclohexen-1-yl)acetamide
SMILESCC(=O)NC1=C(c2ccccc2)CCCC1
InChIInChI=1S/C14H17NO/c1-11(16)15-14-10-6-5-9-13(14)12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-10H2,1H3,(H,15,16)
InChIKeyVNPGMOBYHXPLMS-UHFFFAOYSA-N
XLogP3.11
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylcyclohexen-1-yl)acetamide?
The IUPAC name of N-(2-phenylcyclohexen-1-yl)acetamide (CID 24769089) is N-(2-phenylcyclohexen-1-yl)acetamide.
What is the SMILES notation for N-(2-phenylcyclohexen-1-yl)acetamide?
The canonical SMILES for N-(2-phenylcyclohexen-1-yl)acetamide is CC(=O)NC1=C(c2ccccc2)CCCC1.
What is the InChIKey of N-(2-phenylcyclohexen-1-yl)acetamide?
The InChIKey is VNPGMOBYHXPLMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-11(16)15-14-10-6-5-9-13(14)12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-10H2,1H3,(H,15,16).
What are the key properties of N-(2-phenylcyclohexen-1-yl)acetamide?
N-(2-phenylcyclohexen-1-yl)acetamide has a molecular weight of 215.30 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylcyclohexen-1-yl)acetamide is sourced from PubChem (CID 24769089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).