N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide

C14H27NO6 — CID 162740366

IUPACN-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide
SMILESCOCCOCCOCCOCCNC(=O)CCCC=O
InChIInChI=1S/C14H27NO6/c1-18-8-9-20-12-13-21-11-10-19-7-5-15-14(17)4-2-3-6-16/h6H,2-5,7-13H2,1H3,(H,15,17)
InChIKeyJROXBKMYHISKRU-UHFFFAOYSA-N
MW305.37 g/mol
LogP0.17
Rot. Bonds16

About N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide

N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide (PubChem CID 162740366) has the molecular formula C14H27NO6 and a molecular weight of 305.37 g/mol. Its IUPAC name is N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide.

Molecular Properties

Compound NameN-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide
PubChem CID162740366
Molecular FormulaC14H27NO6
Molecular Weight305.37 g/mol
Exact Mass305.18
IUPAC NameN-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide
SMILESCOCCOCCOCCOCCNC(=O)CCCC=O
InChIInChI=1S/C14H27NO6/c1-18-8-9-20-12-13-21-11-10-19-7-5-15-14(17)4-2-3-6-16/h6H,2-5,7-13H2,1H3,(H,15,17)
InChIKeyJROXBKMYHISKRU-UHFFFAOYSA-N
XLogP0.17
TPSA83.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.37
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pentanamide
CID 134259653
3-methoxy-N-[2-[2-[2-(3-methoxypropanoylamino)ethoxy]ethoxy]ethyl]propanamide
CID 166969109
3-(methylamino)-N-[2-[2-(3-oxopropoxy)ethoxy]ethyl]propanamide
CID 177357974
2-methoxyethyl N-[2-[2-[2-[2-(4-oxobutoxy)ethoxy]ethoxy]ethoxy]ethyl]carbamate
CID 58331196
N-[2-[2-(3-oxopropoxy)ethoxy]ethyl]hexadecanamide
CID 145049534
20-oxo-N-[4-oxo-4-[2-(5-oxopentoxy)ethylamino]butyl]icosanamide
CID 168992305
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-8-sulfanyloctanamide
CID 71381103
N,N'-bis(2-methoxyethyl)hexanediamide
CID 2933923
16-oxo-16-[2-[2-[2-(4-oxobutanoylamino)ethoxy]ethoxy]ethylamino]hexadecanoic acid
CID 173042619
N-[2-(2-methoxyethoxy)ethyl]-3-sulfanylpropanamide
CID 107027119
methane;3-methoxy-N-(3-oxopropyl)propanamide
CID 160698197
N-[2-[2-(3-oxopropoxy)ethoxy]ethyl]-3-sulfanylpropanamide
CID 88982905

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide?
The IUPAC name of N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide (CID 162740366) is N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide.
What is the SMILES notation for N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide?
The canonical SMILES for N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide is COCCOCCOCCOCCNC(=O)CCCC=O.
What is the InChIKey of N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide?
The InChIKey is JROXBKMYHISKRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO6/c1-18-8-9-20-12-13-21-11-10-19-7-5-15-14(17)4-2-3-6-16/h6H,2-5,7-13H2,1H3,(H,15,17).
What are the key properties of N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide?
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide has a molecular weight of 305.37 g/mol, XLogP of 0.17, 16 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide is sourced from PubChem (CID 162740366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).