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

C15H31NO7S — CID 177226030

IUPACN-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide
SMILESCOCCOCCOCCOCCNC(=O)CCCCS(C)(=O)=O
InChIInChI=1S/C15H31NO7S/c1-20-8-9-22-12-13-23-11-10-21-7-6-16-15(17)5-3-4-14-24(2,18)19/h3-14H2,1-2H3,(H,16,17)
InChIKeyQHWYBVWLSZRESB-UHFFFAOYSA-N
MW369.48 g/mol
LogP0.01
Rot. Bonds17

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

N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide (PubChem CID 177226030) has the molecular formula C15H31NO7S and a molecular weight of 369.48 g/mol. Its IUPAC name is N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide.

Molecular Properties

Compound NameN-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide
PubChem CID177226030
Molecular FormulaC15H31NO7S
Molecular Weight369.48 g/mol
Exact Mass369.18
IUPAC NameN-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide
SMILESCOCCOCCOCCOCCNC(=O)CCCCS(C)(=O)=O
InChIInChI=1S/C15H31NO7S/c1-20-8-9-22-12-13-23-11-10-21-7-6-16-15(17)5-3-4-14-24(2,18)19/h3-14H2,1-2H3,(H,16,17)
InChIKeyQHWYBVWLSZRESB-UHFFFAOYSA-N
XLogP0.01
TPSA100.16 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds17
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.48
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'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
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-8-sulfanyloctanamide
CID 71381103
N,N'-bis(2-methoxyethyl)hexanediamide
CID 2933923
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide
CID 162740366
9-methoxy-N-[2-[2-[2-[2-[2-[2-(2-oxopropoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]nonanamide
CID 155405230
5-methoxy-N-(2-methoxyethyl)pentanamide
CID 58281484
N-[2-(2-methoxyethoxy)ethyl]-3-sulfanylpropanamide
CID 107027119
3-(2-methoxyethoxy)-N-(3-methylsulfonylpropyl)propan-1-amine
CID 103409415
N-[2-(2-methoxyethoxy)ethyl]-6,8-bis(sulfanyl)octanamide
CID 102100758
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-N'-[2-[2-[[4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethylamino]-4-oxobutanoyl]amino]ethyldisulfanyl]ethyl]butanediamide
CID 50942114
N-[2-(2-methoxyethoxy)ethyl]-4,4-dimethylpentanamide
CID 139430629

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide?
The IUPAC name of N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide (CID 177226030) is N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide.
What is the SMILES notation for N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide?
The canonical SMILES for N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide is COCCOCCOCCOCCNC(=O)CCCCS(C)(=O)=O.
What is the InChIKey of N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide?
The InChIKey is QHWYBVWLSZRESB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO7S/c1-20-8-9-22-12-13-23-11-10-21-7-6-16-15(17)5-3-4-14-24(2,18)19/h3-14H2,1-2H3,(H,16,17).
What are the key properties of N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide?
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide has a molecular weight of 369.48 g/mol, XLogP of 0.01, 17 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-methylsulfonylpentanamide is sourced from PubChem (CID 177226030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).