(E)-3-cyclohexyl-N-methylprop-2-enamide

C10H17NO — CID 11378715

IUPAC(E)-3-cyclohexyl-N-methylprop-2-enamide
SMILESCNC(=O)/C=C/C1CCCCC1
InChIInChI=1S/C10H17NO/c1-11-10(12)8-7-9-5-3-2-4-6-9/h7-9H,2-6H2,1H3,(H,11,12)/b8-7+
InChIKeyZOCNWUOYKKXXQM-BQYQJAHWSA-N
MW167.25 g/mol
LogP1.87
Rot. Bonds2

About (E)-3-cyclohexyl-N-methylprop-2-enamide

(E)-3-cyclohexyl-N-methylprop-2-enamide (PubChem CID 11378715) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is (E)-3-cyclohexyl-N-methylprop-2-enamide.

Molecular Properties

Compound Name(E)-3-cyclohexyl-N-methylprop-2-enamide
PubChem CID11378715
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name(E)-3-cyclohexyl-N-methylprop-2-enamide
SMILESCNC(=O)/C=C/C1CCCCC1
InChIInChI=1S/C10H17NO/c1-11-10(12)8-7-9-5-3-2-4-6-9/h7-9H,2-6H2,1H3,(H,11,12)/b8-7+
InChIKeyZOCNWUOYKKXXQM-BQYQJAHWSA-N
XLogP1.87
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-3-cyclohexyl-N-methylprop-2-enamide?
The IUPAC name of (E)-3-cyclohexyl-N-methylprop-2-enamide (CID 11378715) is (E)-3-cyclohexyl-N-methylprop-2-enamide.
What is the SMILES notation for (E)-3-cyclohexyl-N-methylprop-2-enamide?
The canonical SMILES for (E)-3-cyclohexyl-N-methylprop-2-enamide is CNC(=O)/C=C/C1CCCCC1.
What is the InChIKey of (E)-3-cyclohexyl-N-methylprop-2-enamide?
The InChIKey is ZOCNWUOYKKXXQM-BQYQJAHWSA-N. The full InChI is InChI=1S/C10H17NO/c1-11-10(12)8-7-9-5-3-2-4-6-9/h7-9H,2-6H2,1H3,(H,11,12)/b8-7+.
What are the key properties of (E)-3-cyclohexyl-N-methylprop-2-enamide?
(E)-3-cyclohexyl-N-methylprop-2-enamide has a molecular weight of 167.25 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-cyclohexyl-N-methylprop-2-enamide is sourced from PubChem (CID 11378715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).