N-butyl-N-ethenylacetamide

C8H15NO — CID 13204153

IUPACN-butyl-N-ethenylacetamide
SMILESC=CN(CCCC)C(C)=O
InChIInChI=1S/C8H15NO/c1-4-6-7-9(5-2)8(3)10/h5H,2,4,6-7H2,1,3H3
InChIKeyZBOGIZPRKHYUDS-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.78
Rot. Bonds4

About N-butyl-N-ethenylacetamide

N-butyl-N-ethenylacetamide (PubChem CID 13204153) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-butyl-N-ethenylacetamide.

Molecular Properties

Compound NameN-butyl-N-ethenylacetamide
PubChem CID13204153
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-butyl-N-ethenylacetamide
SMILESC=CN(CCCC)C(C)=O
InChIInChI=1S/C8H15NO/c1-4-6-7-9(5-2)8(3)10/h5H,2,4,6-7H2,1,3H3
InChIKeyZBOGIZPRKHYUDS-UHFFFAOYSA-N
XLogP1.78
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
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-butyl-N-ethenylacetamide?
The IUPAC name of N-butyl-N-ethenylacetamide (CID 13204153) is N-butyl-N-ethenylacetamide.
What is the SMILES notation for N-butyl-N-ethenylacetamide?
The canonical SMILES for N-butyl-N-ethenylacetamide is C=CN(CCCC)C(C)=O.
What is the InChIKey of N-butyl-N-ethenylacetamide?
The InChIKey is ZBOGIZPRKHYUDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-4-6-7-9(5-2)8(3)10/h5H,2,4,6-7H2,1,3H3.
What are the key properties of N-butyl-N-ethenylacetamide?
N-butyl-N-ethenylacetamide has a molecular weight of 141.21 g/mol, XLogP of 1.78, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-ethenylacetamide is sourced from PubChem (CID 13204153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).