2-ethoxy-N-methyl-N-pent-4-enylacetamide

C10H19NO2 — CID 115640280

IUPAC2-ethoxy-N-methyl-N-pent-4-enylacetamide
SMILESC=CCCCN(C)C(=O)COCC
InChIInChI=1S/C10H19NO2/c1-4-6-7-8-11(3)10(12)9-13-5-2/h4H,1,5-9H2,2-3H3
InChIKeyLDMVUSWZZMMWNQ-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.45
Rot. Bonds7

About 2-ethoxy-N-methyl-N-pent-4-enylacetamide

2-ethoxy-N-methyl-N-pent-4-enylacetamide (PubChem CID 115640280) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-ethoxy-N-methyl-N-pent-4-enylacetamide.

Molecular Properties

Compound Name2-ethoxy-N-methyl-N-pent-4-enylacetamide
PubChem CID115640280
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2-ethoxy-N-methyl-N-pent-4-enylacetamide
SMILESC=CCCCN(C)C(=O)COCC
InChIInChI=1S/C10H19NO2/c1-4-6-7-8-11(3)10(12)9-13-5-2/h4H,1,5-9H2,2-3H3
InChIKeyLDMVUSWZZMMWNQ-UHFFFAOYSA-N
XLogP1.45
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.45
H-Bond Donors ≤ 50
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-ethoxy-N,N-bis(prop-2-enyl)acetamide
CID 4338567
N-but-3-enyl-2-propoxyacetamide
CID 17780693
[2-(3,4-dihydro-2H-pyridin-1-yl)-2-oxoethyl] acetate
CID 140988581
2-(2-methoxyethoxy)-N-pent-4-enylacetamide
CID 142217191
N,N-bis(2-methoxyethyl)pent-4-enamide
CID 144366863
N-(2-methoxyethyl)-N-methylpent-4-enamide
CID 156294092
2-(2-Methoxyethoxy)-1-(2,3,6,7-tetrahydroazepin-1-yl)ethanone
CID 166785647
2-[2-[bis(prop-2-enyl)amino]-2-oxoethoxy]-N-ethyl-N-prop-2-enylacetamide
CID 166930748
4-(3-Butenyl)-3,5-morpholinedione
CID 12825197
2-but-3-enoxy-N-(2-cyanoethyl)-N-methylacetamide
CID 43289819
2-ethoxy-N-ethyl-N-prop-2-enylacetamide
CID 78983317
N-(2-cyanoethyl)-N-methyl-2-pent-4-enoxyacetamide
CID 79114381

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-methyl-N-pent-4-enylacetamide?
The IUPAC name of 2-ethoxy-N-methyl-N-pent-4-enylacetamide (CID 115640280) is 2-ethoxy-N-methyl-N-pent-4-enylacetamide.
What is the SMILES notation for 2-ethoxy-N-methyl-N-pent-4-enylacetamide?
The canonical SMILES for 2-ethoxy-N-methyl-N-pent-4-enylacetamide is C=CCCCN(C)C(=O)COCC.
What is the InChIKey of 2-ethoxy-N-methyl-N-pent-4-enylacetamide?
The InChIKey is LDMVUSWZZMMWNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-4-6-7-8-11(3)10(12)9-13-5-2/h4H,1,5-9H2,2-3H3.
What are the key properties of 2-ethoxy-N-methyl-N-pent-4-enylacetamide?
2-ethoxy-N-methyl-N-pent-4-enylacetamide has a molecular weight of 185.27 g/mol, XLogP of 1.45, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-methyl-N-pent-4-enylacetamide is sourced from PubChem (CID 115640280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).