2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide

C14H29NO3 — CID 138727288

IUPAC2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide
SMILESCC(C)CCCOCCOCCNC(=O)C(C)C
InChIInChI=1S/C14H29NO3/c1-12(2)6-5-8-17-10-11-18-9-7-15-14(16)13(3)4/h12-13H,5-11H2,1-4H3,(H,15,16)
InChIKeyGQJFMWHNEBUUHN-UHFFFAOYSA-N
MW259.39 g/mol
LogP2.23
Rot. Bonds11

About 2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide

2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide (PubChem CID 138727288) has the molecular formula C14H29NO3 and a molecular weight of 259.39 g/mol. Its IUPAC name is 2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide
PubChem CID138727288
Molecular FormulaC14H29NO3
Molecular Weight259.39 g/mol
Exact Mass259.21
IUPAC Name2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide
SMILESCC(C)CCCOCCOCCNC(=O)C(C)C
InChIInChI=1S/C14H29NO3/c1-12(2)6-5-8-17-10-11-18-9-7-15-14(16)13(3)4/h12-13H,5-11H2,1-4H3,(H,15,16)
InChIKeyGQJFMWHNEBUUHN-UHFFFAOYSA-N
XLogP2.23
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]acetamide
CID 153390509
2-methyl-N-[2-(4-methylpentoxy)ethyl]butanamide
CID 156530460
N-[2-(4-methylpentoxy)ethyl]acetamide
CID 138727622
2-methyl-N-[2-[2-[2-[2-[2-(5-methyl-2-oxohexoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 167576629
2-methyl-N-[2-[2-[2-[2-(6-methyl-4-oxoheptoxy)ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 158884270
N-[2-(2-chloroethoxy)ethyl]-2-methylpropanamide
CID 114297620
3-methyl-N-[2-[2-[2-[2-[2-(2-methylpropanoylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide
CID 129177570
2-methyl-N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 138727258
2-methyl-N-[2-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 138727326
N-[2-[2-[2-[2-[2-(2-hydrazinylethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-methylpropanamide
CID 156530272
2-methyl-N-[2-[2-[2-(2-methylpropylcarbamoylamino)ethoxy]ethoxy]ethyl]propanamide
CID 138727149
2-methyl-N-[2-(2-methylpropoxy)ethyl]propanamide
CID 115588551

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide?
The IUPAC name of 2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide (CID 138727288) is 2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide.
What is the SMILES notation for 2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide?
The canonical SMILES for 2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide is CC(C)CCCOCCOCCNC(=O)C(C)C.
What is the InChIKey of 2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide?
The InChIKey is GQJFMWHNEBUUHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO3/c1-12(2)6-5-8-17-10-11-18-9-7-15-14(16)13(3)4/h12-13H,5-11H2,1-4H3,(H,15,16).
What are the key properties of 2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide?
2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide has a molecular weight of 259.39 g/mol, XLogP of 2.23, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]propanamide is sourced from PubChem (CID 138727288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).