(E)-N,3-dicyclohexylprop-2-enamide

C15H25NO — CID 127126842

IUPAC(E)-N,3-dicyclohexylprop-2-enamide
SMILESO=C(/C=C/C1CCCCC1)NC1CCCCC1
InChIInChI=1S/C15H25NO/c17-15(16-14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h11-14H,1-10H2,(H,16,17)/b12-11+
InChIKeyWFWOERUQMSGWAV-VAWYXSNFSA-N
MW235.37 g/mol
LogP3.57
Rot. Bonds3

About (E)-N,3-dicyclohexylprop-2-enamide

(E)-N,3-dicyclohexylprop-2-enamide (PubChem CID 127126842) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is (E)-N,3-dicyclohexylprop-2-enamide.

Molecular Properties

Compound Name(E)-N,3-dicyclohexylprop-2-enamide
PubChem CID127126842
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name(E)-N,3-dicyclohexylprop-2-enamide
SMILESO=C(/C=C/C1CCCCC1)NC1CCCCC1
InChIInChI=1S/C15H25NO/c17-15(16-14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h11-14H,1-10H2,(H,16,17)/b12-11+
InChIKeyWFWOERUQMSGWAV-VAWYXSNFSA-N
XLogP3.57
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.57
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)-N,3-dicyclohexylprop-2-enamide?
The IUPAC name of (E)-N,3-dicyclohexylprop-2-enamide (CID 127126842) is (E)-N,3-dicyclohexylprop-2-enamide.
What is the SMILES notation for (E)-N,3-dicyclohexylprop-2-enamide?
The canonical SMILES for (E)-N,3-dicyclohexylprop-2-enamide is O=C(/C=C/C1CCCCC1)NC1CCCCC1.
What is the InChIKey of (E)-N,3-dicyclohexylprop-2-enamide?
The InChIKey is WFWOERUQMSGWAV-VAWYXSNFSA-N. The full InChI is InChI=1S/C15H25NO/c17-15(16-14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h11-14H,1-10H2,(H,16,17)/b12-11+.
What are the key properties of (E)-N,3-dicyclohexylprop-2-enamide?
(E)-N,3-dicyclohexylprop-2-enamide has a molecular weight of 235.37 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,3-dicyclohexylprop-2-enamide is sourced from PubChem (CID 127126842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).