N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide

C11H19NO2 — CID 89093020

IUPACN-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide
SMILESC=CCOC(CC(=C)C)C(=O)NCC
InChIInChI=1S/C11H19NO2/c1-5-7-14-10(8-9(3)4)11(13)12-6-2/h5,10H,1,3,6-8H2,2,4H3,(H,12,13)
InChIKeyJKWFNSIRPREAIM-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.66
Rot. Bonds7

About N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide

N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide (PubChem CID 89093020) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide.

Molecular Properties

Compound NameN-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide
PubChem CID89093020
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC NameN-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide
SMILESC=CCOC(CC(=C)C)C(=O)NCC
InChIInChI=1S/C11H19NO2/c1-5-7-14-10(8-9(3)4)11(13)12-6-2/h5,10H,1,3,6-8H2,2,4H3,(H,12,13)
InChIKeyJKWFNSIRPREAIM-UHFFFAOYSA-N
XLogP1.66
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.66
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

3-cyclopropyl-N-ethyl-2-prop-2-enoxypropanamide
CID 89093021
2,2,7-trimethyl-5-prop-2-enoxyoct-7-en-4-one
CID 59143620
N-ethyl-2-(2-methylprop-2-enyl)hex-5-enamide
CID 89093050
(2S)-N'-ethyl-3-(2-methylprop-2-enyl)-2-prop-2-enylbutanediamide
CID 89200891
2-ethoxy-4-methyl-N-propan-2-ylpent-4-enamide
CID 21366326
3-methoxy-2-prop-2-enoxypropanehydrazide
CID 103229178
2-(2-cyclopropylethyl)-N-ethyl-4-methylpent-4-enamide
CID 89093747
1-(ethylamino)-1-oxobut-3-ene-2-sulfinate
CID 57280782
N,4-dimethyl-2-prop-2-enylpent-4-enamide
CID 89102883
1-prop-2-enoxypropyl acetate
CID 142726831
N-ethyl-2-methylpropanamide;molecular hydrogen;prop-1-ene
CID 144853792
prop-2-enyl N-[1-(methoxyamino)-4-methyl-1-oxopent-4-en-2-yl]carbamate
CID 11776504

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide?
The IUPAC name of N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide (CID 89093020) is N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide.
What is the SMILES notation for N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide?
The canonical SMILES for N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide is C=CCOC(CC(=C)C)C(=O)NCC.
What is the InChIKey of N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide?
The InChIKey is JKWFNSIRPREAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-5-7-14-10(8-9(3)4)11(13)12-6-2/h5,10H,1,3,6-8H2,2,4H3,(H,12,13).
What are the key properties of N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide?
N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide has a molecular weight of 197.28 g/mol, XLogP of 1.66, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-2-prop-2-enoxypent-4-enamide is sourced from PubChem (CID 89093020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).