N-but-1-en-2-yl-N-ethylacetamide

C8H15NO — CID 145273180

IUPACN-but-1-en-2-yl-N-ethylacetamide
SMILESC=C(CC)N(CC)C(C)=O
InChIInChI=1S/C8H15NO/c1-5-7(3)9(6-2)8(4)10/h3,5-6H2,1-2,4H3
InChIKeyMSOABSRTOWNJJA-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.78
Rot. Bonds3

About N-but-1-en-2-yl-N-ethylacetamide

N-but-1-en-2-yl-N-ethylacetamide (PubChem CID 145273180) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-but-1-en-2-yl-N-ethylacetamide.

Molecular Properties

Compound NameN-but-1-en-2-yl-N-ethylacetamide
PubChem CID145273180
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-but-1-en-2-yl-N-ethylacetamide
SMILESC=C(CC)N(CC)C(C)=O
InChIInChI=1S/C8H15NO/c1-5-7(3)9(6-2)8(4)10/h3,5-6H2,1-2,4H3
InChIKeyMSOABSRTOWNJJA-UHFFFAOYSA-N
XLogP1.78
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-but-1-en-2-yl-N-ethylacetamide?
The IUPAC name of N-but-1-en-2-yl-N-ethylacetamide (CID 145273180) is N-but-1-en-2-yl-N-ethylacetamide.
What is the SMILES notation for N-but-1-en-2-yl-N-ethylacetamide?
The canonical SMILES for N-but-1-en-2-yl-N-ethylacetamide is C=C(CC)N(CC)C(C)=O.
What is the InChIKey of N-but-1-en-2-yl-N-ethylacetamide?
The InChIKey is MSOABSRTOWNJJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-5-7(3)9(6-2)8(4)10/h3,5-6H2,1-2,4H3.
What are the key properties of N-but-1-en-2-yl-N-ethylacetamide?
N-but-1-en-2-yl-N-ethylacetamide has a molecular weight of 141.21 g/mol, XLogP of 1.78, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-but-1-en-2-yl-N-ethylacetamide is sourced from PubChem (CID 145273180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).