N-[2-(ethylamino)ethyl]acetamide;propane

C9H22N2O — CID 159314545

IUPACN-[2-(ethylamino)ethyl]acetamide;propane
SMILESCCC.CCNCCNC(C)=O
InChIInChI=1S/C6H14N2O.C3H8/c1-3-7-4-5-8-6(2)9;1-3-2/h7H,3-5H2,1-2H3,(H,8,9);3H2,1-2H3
InChIKeyLCYWMPSWXXVOEP-UHFFFAOYSA-N
MW174.29 g/mol
LogP1.15
Rot. Bonds4

About N-[2-(ethylamino)ethyl]acetamide;propane

N-[2-(ethylamino)ethyl]acetamide;propane (PubChem CID 159314545) has the molecular formula C9H22N2O and a molecular weight of 174.29 g/mol. Its IUPAC name is N-[2-(ethylamino)ethyl]acetamide;propane.

Molecular Properties

Compound NameN-[2-(ethylamino)ethyl]acetamide;propane
PubChem CID159314545
Molecular FormulaC9H22N2O
Molecular Weight174.29 g/mol
Exact Mass174.17
IUPAC NameN-[2-(ethylamino)ethyl]acetamide;propane
SMILESCCC.CCNCCNC(C)=O
InChIInChI=1S/C6H14N2O.C3H8/c1-3-7-4-5-8-6(2)9;1-3-2/h7H,3-5H2,1-2H3,(H,8,9);3H2,1-2H3
InChIKeyLCYWMPSWXXVOEP-UHFFFAOYSA-N
XLogP1.15
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.29
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-[2-[2-(ethylamino)ethylamino]ethylamino]ethylamino]ethyl]acetamide
CID 88534902
2-acetamido-N-[2-(ethylamino)ethyl]acetamide
CID 62657470
N-[2-[2-[2-(ethylamino)ethylamino]ethoxy]ethyl]acetamide
CID 155740927
N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide
CID 43807754
N-[2-(2-methylprop-2-enylamino)ethyl]acetamide
CID 60691853
N-[2-(2,2,2-trifluoroethylamino)ethyl]acetamide
CID 43401592
CID 88764909
CID 88764909
N-ethylacetamide;hydrochloride
CID 87177071
N-(3-acetamidopropyl)acetamide
CID 5147555
N-[2-(2-propylsulfonylethylamino)ethyl]acetamide
CID 106723232
N-[2-(prop-1-en-2-ylamino)ethyl]acetamide
CID 21030566
benzene;N-ethylacetamide;propane
CID 123217634

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylamino)ethyl]acetamide;propane?
The IUPAC name of N-[2-(ethylamino)ethyl]acetamide;propane (CID 159314545) is N-[2-(ethylamino)ethyl]acetamide;propane.
What is the SMILES notation for N-[2-(ethylamino)ethyl]acetamide;propane?
The canonical SMILES for N-[2-(ethylamino)ethyl]acetamide;propane is CCC.CCNCCNC(C)=O.
What is the InChIKey of N-[2-(ethylamino)ethyl]acetamide;propane?
The InChIKey is LCYWMPSWXXVOEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O.C3H8/c1-3-7-4-5-8-6(2)9;1-3-2/h7H,3-5H2,1-2H3,(H,8,9);3H2,1-2H3.
What are the key properties of N-[2-(ethylamino)ethyl]acetamide;propane?
N-[2-(ethylamino)ethyl]acetamide;propane has a molecular weight of 174.29 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylamino)ethyl]acetamide;propane is sourced from PubChem (CID 159314545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).