N-(2-methoxyethyl)-3-methylhex-4-enamide

C10H19NO2 — CID 90881390

IUPACN-(2-methoxyethyl)-3-methylhex-4-enamide
SMILESCC=CC(C)CC(=O)NCCOC
InChIInChI=1S/C10H19NO2/c1-4-5-9(2)8-10(12)11-6-7-13-3/h4-5,9H,6-8H2,1-3H3,(H,11,12)
InChIKeyUJNSTIUKXJOUKL-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.35
Rot. Bonds6

About N-(2-methoxyethyl)-3-methylhex-4-enamide

N-(2-methoxyethyl)-3-methylhex-4-enamide (PubChem CID 90881390) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-methylhex-4-enamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-methylhex-4-enamide
PubChem CID90881390
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-(2-methoxyethyl)-3-methylhex-4-enamide
SMILESCC=CC(C)CC(=O)NCCOC
InChIInChI=1S/C10H19NO2/c1-4-5-9(2)8-10(12)11-6-7-13-3/h4-5,9H,6-8H2,1-3H3,(H,11,12)
InChIKeyUJNSTIUKXJOUKL-UHFFFAOYSA-N
XLogP1.35
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 ≤ 51.35
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

Icosa-5,8,11,14-tetraenoic acid (2-methoxy-ethyl)-amide (0609)
CID 44313787
(4Z,7Z,10Z,13Z,16Z,19Z)-N-(2-methoxyethyl)docosa-4,7,10,13,16,19-hexaenamide
CID 90071169
(4Z,7Z,10Z,13Z)-N-(2-hydroxyethyl)hexadeca-4,7,10,13-tetraenamide
CID 164452281
(3R,11R)-3,11-dimethyl-1-oxa-4-azacyclododec-8-ene-5,12-dione
CID 6709784
6-But-2-enyl-1,4-oxazepan-5-one
CID 53683626
N-(2-methoxyethyl)icosa-5,8,11,14-tetraenamide
CID 53846610
N-(2-hydroxyethyl)hex-4-enamide
CID 57112213
N-[2-(methylaminomethoxy)ethyl]hex-4-enamide
CID 60072520
6-[(E)-but-2-enyl]-1,4-oxazepan-5-one
CID 67770472
(11E)-1,4-dioxa-7,16-diazacyclooctadec-11-ene-8,15-dione
CID 70826442
(4Z,7Z,10Z,13Z,16Z,19Z)-N-[2-(2-methoxyethoxy)ethyl]docosa-4,7,10,13,16,19-hexaenamide
CID 71510532
(4Z,7Z,10Z,13Z,16Z,19Z)-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]docosa-4,7,10,13,16,19-hexaenamide
CID 71510663

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-methylhex-4-enamide?
The IUPAC name of N-(2-methoxyethyl)-3-methylhex-4-enamide (CID 90881390) is N-(2-methoxyethyl)-3-methylhex-4-enamide.
What is the SMILES notation for N-(2-methoxyethyl)-3-methylhex-4-enamide?
The canonical SMILES for N-(2-methoxyethyl)-3-methylhex-4-enamide is CC=CC(C)CC(=O)NCCOC.
What is the InChIKey of N-(2-methoxyethyl)-3-methylhex-4-enamide?
The InChIKey is UJNSTIUKXJOUKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-4-5-9(2)8-10(12)11-6-7-13-3/h4-5,9H,6-8H2,1-3H3,(H,11,12).
What are the key properties of N-(2-methoxyethyl)-3-methylhex-4-enamide?
N-(2-methoxyethyl)-3-methylhex-4-enamide has a molecular weight of 185.27 g/mol, XLogP of 1.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-methylhex-4-enamide is sourced from PubChem (CID 90881390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).