3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide

C11H24N2O2 — CID 104761146

IUPAC3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide
SMILESCC(C)NCCC(=O)NCCOC(C)C
InChIInChI=1S/C11H24N2O2/c1-9(2)12-6-5-11(14)13-7-8-15-10(3)4/h9-10,12H,5-8H2,1-4H3,(H,13,14)
InChIKeyWNVBEISBKRSZAI-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.92
Rot. Bonds8

About 3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide

3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide (PubChem CID 104761146) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide.

Molecular Properties

Compound Name3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide
PubChem CID104761146
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide
SMILESCC(C)NCCC(=O)NCCOC(C)C
InChIInChI=1S/C11H24N2O2/c1-9(2)12-6-5-11(14)13-7-8-15-10(3)4/h9-10,12H,5-8H2,1-4H3,(H,13,14)
InChIKeyWNVBEISBKRSZAI-UHFFFAOYSA-N
XLogP0.92
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)acetamide
CID 104761099
2-[3-(propan-2-ylamino)propanoylamino]ethyl carbamate
CID 83210184
3-(propan-2-ylamino)-N-(2-prop-1-en-2-yloxyethyl)propanamide
CID 177062284
N-(2-hydroxyethyl)-3-(propan-2-ylamino)propanamide
CID 60853066
N-[2-(2-methylprop-2-enoxy)ethyl]-3-(propan-2-ylamino)propanamide
CID 114467955
3-(cyclopropylamino)-N-(2-propan-2-yloxyethyl)propanamide
CID 104761100
N-(2-propan-2-yloxyethyl)propan-2-amine
CID 21034307
molecular hydrogen;4-oxo-N-(2-propan-2-yloxyethyl)hexanamide
CID 167491249
4-[3-(propan-2-ylamino)propanoylamino]butanoic acid
CID 61157472
4-methyl-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]pentanamide
CID 171803932
4-methyl-N-[2-(2-propan-2-yloxyethoxy)ethyl]pentanamide
CID 176759210
N-[4-(methylamino)butyl]-4-propan-2-yloxybutanamide
CID 162749933

Frequently Asked Questions

What is the IUPAC name of 3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide?
The IUPAC name of 3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide (CID 104761146) is 3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide.
What is the SMILES notation for 3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide?
The canonical SMILES for 3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide is CC(C)NCCC(=O)NCCOC(C)C.
What is the InChIKey of 3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide?
The InChIKey is WNVBEISBKRSZAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-9(2)12-6-5-11(14)13-7-8-15-10(3)4/h9-10,12H,5-8H2,1-4H3,(H,13,14).
What are the key properties of 3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide?
3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide has a molecular weight of 216.32 g/mol, XLogP of 0.92, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(propan-2-ylamino)-N-(2-propan-2-yloxyethyl)propanamide is sourced from PubChem (CID 104761146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).