N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide

C9H16N2O2 — CID 79286728

IUPACN-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide
SMILESC#CCNCC(=O)NCCOCC
InChIInChI=1S/C9H16N2O2/c1-3-5-10-8-9(12)11-6-7-13-4-2/h1,10H,4-8H2,2H3,(H,11,12)
InChIKeyBZFPVAAPMIEQAH-UHFFFAOYSA-N
MW184.24 g/mol
LogP-0.64
Rot. Bonds7

About N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide

N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide (PubChem CID 79286728) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide
PubChem CID79286728
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide
SMILESC#CCNCC(=O)NCCOCC
InChIInChI=1S/C9H16N2O2/c1-3-5-10-8-9(12)11-6-7-13-4-2/h1,10H,4-8H2,2H3,(H,11,12)
InChIKeyBZFPVAAPMIEQAH-UHFFFAOYSA-N
XLogP-0.64
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-acetamidoethyl)-2-(prop-2-ynylamino)acetamide
CID 112722327
N-(2-aminoethyl)-2-(prop-2-ynylamino)acetamide
CID 79287786
N-[4-(2-methoxyethoxy)butyl]-2-(prop-2-ynylamino)acetamide
CID 113463825
N-(3-propan-2-yloxypropyl)-2-(prop-2-ynylamino)acetamide
CID 112722354
2-amino-N-[2-(2-ethoxyethylamino)-2-oxoethyl]acetamide
CID 60846761
2-(2-ethoxyethylamino)-N-(3-methoxypropyl)acetamide
CID 61486039
N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-(prop-2-ynylamino)acetamide
CID 79271047
N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]propanamide
CID 122664379
N-[2-(methylamino)-2-oxoethyl]-2-(prop-2-ynylamino)acetamide
CID 78912839
N-(3-cyclohexyloxypropyl)-2-(prop-2-ynylamino)acetamide
CID 79286966
4-methylidene-1-(prop-2-ynylamino)hexan-2-one
CID 116589640
N-(2-ethoxyethyl)-3-methylbutanamide
CID 58439580

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide?
The IUPAC name of N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide (CID 79286728) is N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide.
What is the SMILES notation for N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide?
The canonical SMILES for N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide is C#CCNCC(=O)NCCOCC.
What is the InChIKey of N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide?
The InChIKey is BZFPVAAPMIEQAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-3-5-10-8-9(12)11-6-7-13-4-2/h1,10H,4-8H2,2H3,(H,11,12).
What are the key properties of N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide?
N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide has a molecular weight of 184.24 g/mol, XLogP of -0.64, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-2-(prop-2-ynylamino)acetamide is sourced from PubChem (CID 79286728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).