N-ethyl-2-(prop-2-ynylamino)propanamide

C8H14N2O — CID 43086396

IUPACN-ethyl-2-(prop-2-ynylamino)propanamide
SMILESC#CCNC(C)C(=O)NCC
InChIInChI=1S/C8H14N2O/c1-4-6-10-7(3)8(11)9-5-2/h1,7,10H,5-6H2,2-3H3,(H,9,11)
InChIKeySRHVTKQOOOGDHT-UHFFFAOYSA-N
MW154.21 g/mol
LogP-0.27
Rot. Bonds4

About N-ethyl-2-(prop-2-ynylamino)propanamide

N-ethyl-2-(prop-2-ynylamino)propanamide (PubChem CID 43086396) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is N-ethyl-2-(prop-2-ynylamino)propanamide.

Molecular Properties

Compound NameN-ethyl-2-(prop-2-ynylamino)propanamide
PubChem CID43086396
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC NameN-ethyl-2-(prop-2-ynylamino)propanamide
SMILESC#CCNC(C)C(=O)NCC
InChIInChI=1S/C8H14N2O/c1-4-6-10-7(3)8(11)9-5-2/h1,7,10H,5-6H2,2-3H3,(H,9,11)
InChIKeySRHVTKQOOOGDHT-UHFFFAOYSA-N
XLogP-0.27
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-2-(prop-2-ynylamino)propanamide
CID 43086395
N-ethyl-2-(2-prop-2-ynylsulfanylethylamino)propanamide
CID 106428869
N-ethyl-2-[[2-(ethylamino)-2-oxoethyl]amino]propanamide
CID 43401396
2-(2,3-dimethylbutylamino)-N-ethylpropanamide
CID 64571125
2-(2-aminoethylamino)-N-prop-2-ynylpropanamide
CID 62140900
3-[[1-oxo-1-(prop-2-ynylamino)propan-2-yl]amino]propanoic acid
CID 43466719
2-[2-(diethylamino)ethylamino]-N-prop-2-ynylpropanamide
CID 43112763
2-(2-ethoxypropylamino)-N-prop-2-ynylpropanamide
CID 115663958
N-ethyl-2-(3-hydroxypropylamino)propanamide
CID 43392791
2-(2-methylprop-2-enylamino)-N-prop-2-ynylpropanamide
CID 114616816
N-ethyl-2-(2-methylsulfanylethylamino)propanamide
CID 60672762
2-[2-[ethyl(propyl)amino]ethylamino]-N-prop-2-ynylpropanamide
CID 114133454

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(prop-2-ynylamino)propanamide?
The IUPAC name of N-ethyl-2-(prop-2-ynylamino)propanamide (CID 43086396) is N-ethyl-2-(prop-2-ynylamino)propanamide.
What is the SMILES notation for N-ethyl-2-(prop-2-ynylamino)propanamide?
The canonical SMILES for N-ethyl-2-(prop-2-ynylamino)propanamide is C#CCNC(C)C(=O)NCC.
What is the InChIKey of N-ethyl-2-(prop-2-ynylamino)propanamide?
The InChIKey is SRHVTKQOOOGDHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-4-6-10-7(3)8(11)9-5-2/h1,7,10H,5-6H2,2-3H3,(H,9,11).
What are the key properties of N-ethyl-2-(prop-2-ynylamino)propanamide?
N-ethyl-2-(prop-2-ynylamino)propanamide has a molecular weight of 154.21 g/mol, XLogP of -0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(prop-2-ynylamino)propanamide is sourced from PubChem (CID 43086396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).