(E)-7-cyclopentyl-2-ethoxyhept-6-enamide

C14H25NO2 — CID 143582563

IUPAC(E)-7-cyclopentyl-2-ethoxyhept-6-enamide
SMILESCCOC(CCC/C=C/C1CCCC1)C(N)=O
InChIInChI=1S/C14H25NO2/c1-2-17-13(14(15)16)11-5-3-4-8-12-9-6-7-10-12/h4,8,12-13H,2-3,5-7,9-11H2,1H3,(H2,15,16)/b8-4+
InChIKeyQOUXTNIFXWCGSW-XBXARRHUSA-N
MW239.36 g/mol
LogP2.79
Rot. Bonds8

About (E)-7-cyclopentyl-2-ethoxyhept-6-enamide

(E)-7-cyclopentyl-2-ethoxyhept-6-enamide (PubChem CID 143582563) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is (E)-7-cyclopentyl-2-ethoxyhept-6-enamide.

Molecular Properties

Compound Name(E)-7-cyclopentyl-2-ethoxyhept-6-enamide
PubChem CID143582563
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name(E)-7-cyclopentyl-2-ethoxyhept-6-enamide
SMILESCCOC(CCC/C=C/C1CCCC1)C(N)=O
InChIInChI=1S/C14H25NO2/c1-2-17-13(14(15)16)11-5-3-4-8-12-9-6-7-10-12/h4,8,12-13H,2-3,5-7,9-11H2,1H3,(H2,15,16)/b8-4+
InChIKeyQOUXTNIFXWCGSW-XBXARRHUSA-N
XLogP2.79
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-ethoxyoctanamide
CID 174492663
(E)-2-methoxyundec-6-enamide
CID 143582513
non-1-enylcyclopentane
CID 86065492
(E)-7-cyclopentylhept-6-enoic acid
CID 20506982
dimethyl 2-[(E)-3-cyclohexylprop-2-enyl]propanedioate
CID 102464212
cyclohexyl 2-ethoxypentanoate
CID 70132370
[(E)-hex-1-enyl]cyclopropane
CID 5352188
ethyl (11Z,14Z,17Z)-2-ethoxyicosa-11,14,17-trienoate
CID 59187783
ethyl (E)-7-cyclopropyl-3-oxohept-6-enoate
CID 10013342
ethyl 3-cyclobutylprop-2-enoate
CID 54090850
3-cyclohexylprop-2-enyl hydrogen carbonate
CID 139900277
tetraethyl (E)-dec-5-ene-1,1,10,10-tetracarboxylate
CID 135011026

Frequently Asked Questions

What is the IUPAC name of (E)-7-cyclopentyl-2-ethoxyhept-6-enamide?
The IUPAC name of (E)-7-cyclopentyl-2-ethoxyhept-6-enamide (CID 143582563) is (E)-7-cyclopentyl-2-ethoxyhept-6-enamide.
What is the SMILES notation for (E)-7-cyclopentyl-2-ethoxyhept-6-enamide?
The canonical SMILES for (E)-7-cyclopentyl-2-ethoxyhept-6-enamide is CCOC(CCC/C=C/C1CCCC1)C(N)=O.
What is the InChIKey of (E)-7-cyclopentyl-2-ethoxyhept-6-enamide?
The InChIKey is QOUXTNIFXWCGSW-XBXARRHUSA-N. The full InChI is InChI=1S/C14H25NO2/c1-2-17-13(14(15)16)11-5-3-4-8-12-9-6-7-10-12/h4,8,12-13H,2-3,5-7,9-11H2,1H3,(H2,15,16)/b8-4+.
What are the key properties of (E)-7-cyclopentyl-2-ethoxyhept-6-enamide?
(E)-7-cyclopentyl-2-ethoxyhept-6-enamide has a molecular weight of 239.36 g/mol, XLogP of 2.79, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-7-cyclopentyl-2-ethoxyhept-6-enamide is sourced from PubChem (CID 143582563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).