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

C14H25NO — CID 11447419

IUPAC(E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide
SMILESCCN(CC)C(=O)/C(C)=C/C1CCCCC1
InChIInChI=1S/C14H25NO/c1-4-15(5-2)14(16)12(3)11-13-9-7-6-8-10-13/h11,13H,4-10H2,1-3H3/b12-11+
InChIKeyNSAFKMFLXLWXGY-VAWYXSNFSA-N
MW223.36 g/mol
LogP3.38
Rot. Bonds4

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

(E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide (PubChem CID 11447419) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is (E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide.

Molecular Properties

Compound Name(E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide
PubChem CID11447419
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name(E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide
SMILESCCN(CC)C(=O)/C(C)=C/C1CCCCC1
InChIInChI=1S/C14H25NO/c1-4-15(5-2)14(16)12(3)11-13-9-7-6-8-10-13/h11,13H,4-10H2,1-3H3/b12-11+
InChIKeyNSAFKMFLXLWXGY-VAWYXSNFSA-N
XLogP3.38
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2E)-5,9-dimethyl-1-piperidin-1-yldeca-2,8-dien-1-one
CID 12575259
1-Cyclohexyl-3-dimethylamino-propenone
CID 11095241
(Z)-N,N-dibutyl-3-cyclohexyl-2-(trifluoromethyl)prop-2-enamide
CID 11024099
N-(2-fluoroethyl)-N-methyl-4-propan-2-ylcyclohexa-1,5-diene-1-carboxamide
CID 155197701
1-[(6R)-4,6-dimethyl-6-(2-methylprop-2-enyl)-2,5-dihydropyridin-1-yl]ethanone
CID 101720961
(E)-3-cyclohexyl-N,N,2-trimethylprop-2-enamide
CID 134943122
(2Z,4E)-5-cyclohexyl-2-methyl-1-pyrrolidin-1-ylpenta-2,4-dien-1-one
CID 176436033
1-methyl-3-(6-methylhept-5-en-2-yl)-2H-pyrrol-5-one
CID 10512531
(E)-3-cyclohexyl-N,N-di(propan-2-yl)prop-2-enamide
CID 12124208
(E)-N,N-diethyl-2-methylhept-2-enamide
CID 12124209
(E)-N,N-diethyl-2-methyldec-2-enamide
CID 12124211
(2E)-N,N-diethyl-2,5,9-trimethyldeca-2,8-dienamide
CID 12124212

Frequently Asked Questions

What is the IUPAC name of (E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide?
The IUPAC name of (E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide (CID 11447419) is (E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide.
What is the SMILES notation for (E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide?
The canonical SMILES for (E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide is CCN(CC)C(=O)/C(C)=C/C1CCCCC1.
What is the InChIKey of (E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide?
The InChIKey is NSAFKMFLXLWXGY-VAWYXSNFSA-N. The full InChI is InChI=1S/C14H25NO/c1-4-15(5-2)14(16)12(3)11-13-9-7-6-8-10-13/h11,13H,4-10H2,1-3H3/b12-11+.
What are the key properties of (E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide?
(E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide has a molecular weight of 223.36 g/mol, XLogP of 3.38, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide is sourced from PubChem (CID 11447419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).