2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide

C12H26N2O2 — CID 60672261

IUPAC2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide
SMILESCCOCCCNCC(=O)NC(C)(C)CC
InChIInChI=1S/C12H26N2O2/c1-5-12(3,4)14-11(15)10-13-8-7-9-16-6-2/h13H,5-10H2,1-4H3,(H,14,15)
InChIKeyWBFOZXHQMORILJ-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.31
Rot. Bonds9

About 2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide

2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide (PubChem CID 60672261) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide
PubChem CID60672261
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide
SMILESCCOCCCNCC(=O)NC(C)(C)CC
InChIInChI=1S/C12H26N2O2/c1-5-12(3,4)14-11(15)10-13-8-7-9-16-6-2/h13H,5-10H2,1-4H3,(H,14,15)
InChIKeyWBFOZXHQMORILJ-UHFFFAOYSA-N
XLogP1.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.31
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-(5-methoxypentylamino)-N-(2-methylbutan-2-yl)acetamide
CID 114130456
2-(2-hydroxyethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 60671300
N-(2-methylbutan-2-yl)-2-(pent-4-ynylamino)acetamide
CID 106221318
2-(2-but-3-enoxyethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 106401580
2-(cyclopentylmethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 61486055
N-tert-butyl-2-[3-(2-methylpropoxy)propylamino]acetamide
CID 113219120
3-(3-ethoxypropylamino)-2,2-dimethylpropanoic acid
CID 79629719
2-(3-ethoxypropylamino)-1-morpholin-4-ylethanone
CID 28584674
N-(cyclohexylmethyl)-2-(3-ethoxypropylamino)acetamide
CID 3226695
N-tert-butyl-2-(3-ethoxypropylcarbamothioylamino)acetamide
CID 115573164
N-tert-butyl-2-[[N-(3-ethoxypropyl)-N'-methylcarbamimidoyl]amino]acetamide
CID 111223979
N-ethyl-2-(3-propoxypropylamino)acetamide
CID 82943813

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide (CID 60672261) is 2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide is CCOCCCNCC(=O)NC(C)(C)CC.
What is the InChIKey of 2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is WBFOZXHQMORILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-5-12(3,4)14-11(15)10-13-8-7-9-16-6-2/h13H,5-10H2,1-4H3,(H,14,15).
What are the key properties of 2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide?
2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 230.35 g/mol, XLogP of 1.31, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 60672261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).