(E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide

C16H31NO3 — CID 89264524

IUPAC(E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide
SMILESCC/C=C(\C)CCCCCCC(=O)NCCOCCO
InChIInChI=1S/C16H31NO3/c1-3-8-15(2)9-6-4-5-7-10-16(19)17-11-13-20-14-12-18/h8,18H,3-7,9-14H2,1-2H3,(H,17,19)/b15-8+
InChIKeyCWVMKXOIZVQNQQ-OVCLIPMQSA-N
MW285.43 g/mol
LogP2.81
Rot. Bonds13

About (E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide

(E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide (PubChem CID 89264524) has the molecular formula C16H31NO3 and a molecular weight of 285.43 g/mol. Its IUPAC name is (E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide.

Molecular Properties

Compound Name(E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide
PubChem CID89264524
Molecular FormulaC16H31NO3
Molecular Weight285.43 g/mol
Exact Mass285.23
IUPAC Name(E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide
SMILESCC/C=C(\C)CCCCCCC(=O)NCCOCCO
InChIInChI=1S/C16H31NO3/c1-3-8-15(2)9-6-4-5-7-10-16(19)17-11-13-20-14-12-18/h8,18H,3-7,9-14H2,1-2H3,(H,17,19)/b15-8+
InChIKeyCWVMKXOIZVQNQQ-OVCLIPMQSA-N
XLogP2.81
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]hexadecanamide
CID 102228656
N-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pentanamide
CID 54534992
N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]pentanamide
CID 175944386
(Z)-N-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]octadec-9-enamide
CID 102485842
N'-[2-(2-hydroxyethoxy)ethyl]-N-[2-(2-nitrosoethoxy)ethyl]icosanediamide
CID 122412924
N,N'-bis(3-dodecoxypropyl)decanediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]dodecanediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]tridecanediamide;N,N'-bis(3-methoxypropyl)decanediamide;N,N'-bis(3-methoxypropyl)dodecanediamide;N,N'-bis(3-methoxypropyl)icosanediamide
CID 161275900
N,N'-bis[2-(2-hydroxyethoxy)ethyl]-N'-methylicosanediamide
CID 89140505
2-(2-aminoethoxy)ethanol;decanoic acid;N-[2-(2-hydroxyethoxy)ethyl]decanamide
CID 166636671
N,N'-bis(3-dodecoxypropyl)-8,13-dimethylicosanediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]butanediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]decanediamide;(8E,12E)-N,N'-bis[2-(2-hydroxyethoxy)ethyl]-8,13-dimethylicosa-8,12-dienediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]-8,13-dimethylicosanediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]icosanediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]pentadecanediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]tridecanediamide;N,N'-bis[2-(2-methoxyethoxy)ethyl]-8,13-dimethylicosanediamide;N,N'-bis(3-methoxypropyl)-8,13-dimethylicosanediamide
CID 159471844
9-hydroxy-N-[2-[2-[2-[2-(2-oxopropoxy)ethoxy]ethoxy]ethoxy]ethyl]nonanamide;vanadium
CID 155741032
N-[4-[2-[2-[2-[2-[2-[2-(3-hydroxypropylamino)-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-4-oxobutyl]octadecanamide
CID 166959227
N-[2-(2-hydroxyethoxy)ethyl]-3-[2-[2-[2-[2-(3-oxobutoxy)ethoxy]ethoxy]ethoxy]ethoxy]propanamide
CID 88581795

Frequently Asked Questions

What is the IUPAC name of (E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide?
The IUPAC name of (E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide (CID 89264524) is (E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide.
What is the SMILES notation for (E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide?
The canonical SMILES for (E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide is CC/C=C(\C)CCCCCCC(=O)NCCOCCO.
What is the InChIKey of (E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide?
The InChIKey is CWVMKXOIZVQNQQ-OVCLIPMQSA-N. The full InChI is InChI=1S/C16H31NO3/c1-3-8-15(2)9-6-4-5-7-10-16(19)17-11-13-20-14-12-18/h8,18H,3-7,9-14H2,1-2H3,(H,17,19)/b15-8+.
What are the key properties of (E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide?
(E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide has a molecular weight of 285.43 g/mol, XLogP of 2.81, 13 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[2-(2-hydroxyethoxy)ethyl]-8-methylundec-8-enamide is sourced from PubChem (CID 89264524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).