N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide

C15H31NO5 — CID 131982939

IUPACN-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide
SMILESCC(C)(C)CCC(=O)NCCOCCOCCOCCO
InChIInChI=1S/C15H31NO5/c1-15(2,3)5-4-14(18)16-6-8-19-10-12-21-13-11-20-9-7-17/h17H,4-13H2,1-3H3,(H,16,18)
InChIKeyFLEVEUJUHPQPMX-UHFFFAOYSA-N
MW305.42 g/mol
LogP0.97
Rot. Bonds13

About N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide

N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide (PubChem CID 131982939) has the molecular formula C15H31NO5 and a molecular weight of 305.42 g/mol. Its IUPAC name is N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide.

Molecular Properties

Compound NameN-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide
PubChem CID131982939
Molecular FormulaC15H31NO5
Molecular Weight305.42 g/mol
Exact Mass305.22
IUPAC NameN-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide
SMILESCC(C)(C)CCC(=O)NCCOCCOCCOCCO
InChIInChI=1S/C15H31NO5/c1-15(2,3)5-4-14(18)16-6-8-19-10-12-21-13-11-20-9-7-17/h17H,4-13H2,1-3H3,(H,16,18)
InChIKeyFLEVEUJUHPQPMX-UHFFFAOYSA-N
XLogP0.97
TPSA77.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-methoxyethoxy)ethyl]-4,4-dimethylpentanamide
CID 139430629
N-[2-[2-[2-[2-(4,4-dimethyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide
CID 168855315
N-[2-[2-[3-(2,2-dimethylpropylsulfanyl)propanoylamino]ethoxy]ethyl]-4,4-dimethylpentanamide
CID 134167212
N-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pentanamide
CID 54534992
N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]pentanamide
CID 175944386
N-[2-(2-hydroxyethoxy)ethyl]-3-[2-[2-[2-[2-(3-oxobutoxy)ethoxy]ethoxy]ethoxy]ethoxy]propanamide
CID 88581795
N-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethyl]-7,7-dimethyloctanamide
CID 176614152
4,4-dimethyl-N-[2-[2-(4-oxononadecoxy)ethoxy]ethyl]pentanamide
CID 58070977
3-[2-amino-3-[3-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2-[[3-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethylamino]-3-oxopropoxy]methyl]propoxy]-N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]propanamide
CID 163953950
N-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]-5,5,8,8-tetramethyl-12-(methylamino)dodecanamide
CID 143545425
N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]hexadecanamide
CID 102228656
3-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide
CID 61274475

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide?
The IUPAC name of N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide (CID 131982939) is N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide.
What is the SMILES notation for N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide?
The canonical SMILES for N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide is CC(C)(C)CCC(=O)NCCOCCOCCOCCO.
What is the InChIKey of N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide?
The InChIKey is FLEVEUJUHPQPMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO5/c1-15(2,3)5-4-14(18)16-6-8-19-10-12-21-13-11-20-9-7-17/h17H,4-13H2,1-3H3,(H,16,18).
What are the key properties of N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide?
N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide has a molecular weight of 305.42 g/mol, XLogP of 0.97, 13 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]-4,4-dimethylpentanamide is sourced from PubChem (CID 131982939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).