N-[(E)-hex-2-enyl]-2-methoxypropanamide

C10H19NO2 — CID 178011429

IUPACN-[(E)-hex-2-enyl]-2-methoxypropanamide
SMILESCCC/C=C/CNC(=O)C(C)OC
InChIInChI=1S/C10H19NO2/c1-4-5-6-7-8-11-10(12)9(2)13-3/h6-7,9H,4-5,8H2,1-3H3,(H,11,12)/b7-6+
InChIKeyCHMWPCAGUPTQEH-VOTSOKGWSA-N
MW185.27 g/mol
LogP1.49
Rot. Bonds6

About N-[(E)-hex-2-enyl]-2-methoxypropanamide

N-[(E)-hex-2-enyl]-2-methoxypropanamide (PubChem CID 178011429) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-[(E)-hex-2-enyl]-2-methoxypropanamide.

Molecular Properties

Compound NameN-[(E)-hex-2-enyl]-2-methoxypropanamide
PubChem CID178011429
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-[(E)-hex-2-enyl]-2-methoxypropanamide
SMILESCCC/C=C/CNC(=O)C(C)OC
InChIInChI=1S/C10H19NO2/c1-4-5-6-7-8-11-10(12)9(2)13-3/h6-7,9H,4-5,8H2,1-3H3,(H,11,12)/b7-6+
InChIKeyCHMWPCAGUPTQEH-VOTSOKGWSA-N
XLogP1.49
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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[(2S)-1-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-1-oxopropan-2-yl] acetate
CID 44757663
2-methoxy-N-[(5Z,8Z,11Z,14Z)-16-[methyl(pentyl)amino]hexadeca-5,8,11,14-tetraenyl]acetamide
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N-but-3-enyl-2-propoxyacetamide
CID 17780693
2-methoxy-N-[16-[methyl(pentyl)amino]hexadeca-5,8,11,14-tetraenyl]acetamide
CID 72999749
N-geranyl 2-acetoxypropionamide
CID 86661264
2-but-3-enoxy-N-ethylpropanamide
CID 89129102
(4Z,7Z,10Z,13Z,16Z,19Z)-N-[2-(2-amino-2-oxoethoxy)ethyl]docosa-4,7,10,13,16,19-hexaenamide
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N-[2-hydroxy-3-[methyl-[(Z)-pent-3-enyl]amino]propyl]-2-methoxyacetamide
CID 90250342
N-[(2R)-3-[ethyl-[(Z)-pent-3-enyl]amino]-2-hydroxypropyl]-2-methoxyacetamide
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N-(2-methoxyethyl)hex-4-enamide
CID 90804500

Frequently Asked Questions

What is the IUPAC name of N-[(E)-hex-2-enyl]-2-methoxypropanamide?
The IUPAC name of N-[(E)-hex-2-enyl]-2-methoxypropanamide (CID 178011429) is N-[(E)-hex-2-enyl]-2-methoxypropanamide.
What is the SMILES notation for N-[(E)-hex-2-enyl]-2-methoxypropanamide?
The canonical SMILES for N-[(E)-hex-2-enyl]-2-methoxypropanamide is CCC/C=C/CNC(=O)C(C)OC.
What is the InChIKey of N-[(E)-hex-2-enyl]-2-methoxypropanamide?
The InChIKey is CHMWPCAGUPTQEH-VOTSOKGWSA-N. The full InChI is InChI=1S/C10H19NO2/c1-4-5-6-7-8-11-10(12)9(2)13-3/h6-7,9H,4-5,8H2,1-3H3,(H,11,12)/b7-6+.
What are the key properties of N-[(E)-hex-2-enyl]-2-methoxypropanamide?
N-[(E)-hex-2-enyl]-2-methoxypropanamide has a molecular weight of 185.27 g/mol, XLogP of 1.49, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-hex-2-enyl]-2-methoxypropanamide is sourced from PubChem (CID 178011429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).