N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide

C14H26N2O4 — CID 160705460

IUPACN-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide
SMILESC=C(C)C(=O)NCCOC.COCCC=C(C)C(N)=O
InChIInChI=1S/2C7H13NO2/c1-6(2)7(9)8-4-5-10-3;1-6(7(8)9)4-3-5-10-2/h1,4-5H2,2-3H3,(H,8,9);4H,3,5H2,1-2H3,(H2,8,9)
InChIKeyRRDXOOHDGYODBL-UHFFFAOYSA-N
MW286.37 g/mol
LogP0.78
Rot. Bonds8

About N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide

N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide (PubChem CID 160705460) has the molecular formula C14H26N2O4 and a molecular weight of 286.37 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide
PubChem CID160705460
Molecular FormulaC14H26N2O4
Molecular Weight286.37 g/mol
Exact Mass286.19
IUPAC NameN-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide
SMILESC=C(C)C(=O)NCCOC.COCCC=C(C)C(N)=O
InChIInChI=1S/2C7H13NO2/c1-6(2)7(9)8-4-5-10-3;1-6(7(8)9)4-3-5-10-2/h1,4-5H2,2-3H3,(H,8,9);4H,3,5H2,1-2H3,(H2,8,9)
InChIKeyRRDXOOHDGYODBL-UHFFFAOYSA-N
XLogP0.78
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(E)-N-(2-methoxyethyl)-4,4-dimethylpent-2-enamide
CID 21060447
N-(2-methoxyethyl)cyclobutene-1-carboxamide
CID 24802883
(Z)-N-[2-[2-[[(E)-but-2-enoyl]amino]ethoxy]ethyl]hex-3-enamide
CID 58348975
(E)-2-methyl-N-[2-[2-[[(E)-2-methylhept-2-en-6-ynoyl]amino]ethoxy]ethyl]hept-2-en-6-ynamide
CID 59035240
2-Methylpent-2-enamide;morpholine
CID 66895956
N-butyl-2-methylprop-2-enamide;(E)-2-methylpent-2-enamide
CID 88595485
N-(2-methoxyethyl)-3-methylcyclohexa-1,5-diene-1-carboxamide
CID 89337160
(Z)-N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-2-methylidenehept-3-enamide
CID 89672469
(E)-2-methyl-4-(oxetan-3-ylamino)pent-2-enamide
CID 90151578
(E)-N-(2-methoxyethyl)pent-2-enamide
CID 127125380
N-(2-methoxyethyl)-2-methylbut-2-enamide
CID 131202509
(3Z)-3-ethylidene-N-(2-methoxyethyl)-6-methyl-4-methylidenecyclohexa-1,5-diene-1-carboxamide
CID 134188719

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide?
The IUPAC name of N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide (CID 160705460) is N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide?
The canonical SMILES for N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide is C=C(C)C(=O)NCCOC.COCCC=C(C)C(N)=O.
What is the InChIKey of N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide?
The InChIKey is RRDXOOHDGYODBL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H13NO2/c1-6(2)7(9)8-4-5-10-3;1-6(7(8)9)4-3-5-10-2/h1,4-5H2,2-3H3,(H,8,9);4H,3,5H2,1-2H3,(H2,8,9).
What are the key properties of N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide?
N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide has a molecular weight of 286.37 g/mol, XLogP of 0.78, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-methylprop-2-enamide;5-methoxy-2-methylpent-2-enamide is sourced from PubChem (CID 160705460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).