N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide

C15H25NO2 — CID 123169280

IUPACN-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide
SMILESCC=C(C=C(C)OCC)C(=O)NC1CCCCC1
InChIInChI=1S/C15H25NO2/c1-4-13(11-12(3)18-5-2)15(17)16-14-9-7-6-8-10-14/h4,11,14H,5-10H2,1-3H3,(H,16,17)
InChIKeyVHHAKXGUYMLCMI-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.32
Rot. Bonds5

About N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide

N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide (PubChem CID 123169280) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide.

Molecular Properties

Compound NameN-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide
PubChem CID123169280
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC NameN-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide
SMILESCC=C(C=C(C)OCC)C(=O)NC1CCCCC1
InChIInChI=1S/C15H25NO2/c1-4-13(11-12(3)18-5-2)15(17)16-14-9-7-6-8-10-14/h4,11,14H,5-10H2,1-3H3,(H,16,17)
InChIKeyVHHAKXGUYMLCMI-UHFFFAOYSA-N
XLogP3.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-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

ethyl (E)-3-(cyclohexylamino)but-2-enoate
CID 15555337
(E)-N-cyclohexyl-2-methylbut-2-enamide
CID 14316395
(E)-N-cyclopentyl-2-methylbut-2-enamide
CID 89351716
N-cyclohexyl-2-oxopropanamide
CID 12861109
ethyl 2-(cyclohexylcarbamoylamino)propanoate
CID 54959999
ethyl 2-[[1-(cyclohexylamino)-1-oxopropan-2-yl]amino]propanoate
CID 61498920
methyl (Z)-3-amino-4-(cyclohexylamino)-4-oxobut-2-enoate
CID 16647731
N-cyclohexyl-2-ethoxypropanamide
CID 137320539
ethyl 2-(cyclooctylamino)propanoate
CID 61498293
ethyl (E,4R)-4-(cyclohexylamino)pent-2-enoate
CID 46200258
ethyl 4-(cyclohexylamino)pent-2-enoate
CID 75145895
ethyl (E)-4-(cyclohexylamino)pent-2-enoate
CID 131740586

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide?
The IUPAC name of N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide (CID 123169280) is N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide.
What is the SMILES notation for N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide?
The canonical SMILES for N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide is CC=C(C=C(C)OCC)C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide?
The InChIKey is VHHAKXGUYMLCMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-4-13(11-12(3)18-5-2)15(17)16-14-9-7-6-8-10-14/h4,11,14H,5-10H2,1-3H3,(H,16,17).
What are the key properties of N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide?
N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide has a molecular weight of 251.37 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide is sourced from PubChem (CID 123169280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).