(E)-N-cyclohexyl-4,4-dimethylhex-2-enamide

C14H25NO — CID 166823863

IUPAC(E)-N-cyclohexyl-4,4-dimethylhex-2-enamide
SMILESCCC(C)(C)/C=C/C(=O)NC1CCCCC1
InChIInChI=1S/C14H25NO/c1-4-14(2,3)11-10-13(16)15-12-8-6-5-7-9-12/h10-12H,4-9H2,1-3H3,(H,15,16)/b11-10+
InChIKeyAQPOZQXWVVXPRN-ZHACJKMWSA-N
MW223.36 g/mol
LogP3.43
Rot. Bonds4

About (E)-N-cyclohexyl-4,4-dimethylhex-2-enamide

(E)-N-cyclohexyl-4,4-dimethylhex-2-enamide (PubChem CID 166823863) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is (E)-N-cyclohexyl-4,4-dimethylhex-2-enamide.

Molecular Properties

Compound Name(E)-N-cyclohexyl-4,4-dimethylhex-2-enamide
PubChem CID166823863
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name(E)-N-cyclohexyl-4,4-dimethylhex-2-enamide
SMILESCCC(C)(C)/C=C/C(=O)NC1CCCCC1
InChIInChI=1S/C14H25NO/c1-4-14(2,3)11-10-13(16)15-12-8-6-5-7-9-12/h10-12H,4-9H2,1-3H3,(H,15,16)/b11-10+
InChIKeyAQPOZQXWVVXPRN-ZHACJKMWSA-N
XLogP3.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (E)-N-cyclohexyl-4,4-dimethylhex-2-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-N,N'-dicyclohexylbut-2-enediamide
CID 139188308
N-cyclohexylhexa-2,4-dienamide
CID 71382981
N-cyclodecylprop-2-enamide
CID 18400354
N-cyclohexyl-3-cyclopentylprop-2-enamide
CID 141179456
N-cyclopentyl-2,2-dimethylbutanamide
CID 4627793
(E)-4-bromo-N-cyclopentylbut-2-enamide
CID 153266331
1-cyclohexyl-3-(3-ethylpentan-3-yl)urea
CID 115660907
(E)-3-(4-tert-butylphenyl)-N-cyclohexylprop-2-enamide
CID 1322783
N-cycloheptyl-3-methylbut-2-enamide
CID 51109528
(Z)-N-cyclooctyl-3-(4-ethylphenyl)prop-2-enamide
CID 19579728
N-cyclooctylpropanamide
CID 3387497
N-cyclodecylpropanamide
CID 122483649

Frequently Asked Questions

What is the IUPAC name of (E)-N-cyclohexyl-4,4-dimethylhex-2-enamide?
The IUPAC name of (E)-N-cyclohexyl-4,4-dimethylhex-2-enamide (CID 166823863) is (E)-N-cyclohexyl-4,4-dimethylhex-2-enamide.
What is the SMILES notation for (E)-N-cyclohexyl-4,4-dimethylhex-2-enamide?
The canonical SMILES for (E)-N-cyclohexyl-4,4-dimethylhex-2-enamide is CCC(C)(C)/C=C/C(=O)NC1CCCCC1.
What is the InChIKey of (E)-N-cyclohexyl-4,4-dimethylhex-2-enamide?
The InChIKey is AQPOZQXWVVXPRN-ZHACJKMWSA-N. The full InChI is InChI=1S/C14H25NO/c1-4-14(2,3)11-10-13(16)15-12-8-6-5-7-9-12/h10-12H,4-9H2,1-3H3,(H,15,16)/b11-10+.
What are the key properties of (E)-N-cyclohexyl-4,4-dimethylhex-2-enamide?
(E)-N-cyclohexyl-4,4-dimethylhex-2-enamide has a molecular weight of 223.36 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-cyclohexyl-4,4-dimethylhex-2-enamide is sourced from PubChem (CID 166823863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).