N-ethyl-N-[(E)-prop-1-enyl]acetamide

C7H13NO — CID 22363792

IUPACN-ethyl-N-[(E)-prop-1-enyl]acetamide
SMILESC/C=C/N(CC)C(C)=O
InChIInChI=1S/C7H13NO/c1-4-6-8(5-2)7(3)9/h4,6H,5H2,1-3H3/b6-4+
InChIKeyVQDRUXLXSHHYJT-GQCTYLIASA-N
MW127.19 g/mol
LogP1.39
Rot. Bonds2

About N-ethyl-N-[(E)-prop-1-enyl]acetamide

N-ethyl-N-[(E)-prop-1-enyl]acetamide (PubChem CID 22363792) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is N-ethyl-N-[(E)-prop-1-enyl]acetamide.

Molecular Properties

Compound NameN-ethyl-N-[(E)-prop-1-enyl]acetamide
PubChem CID22363792
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC NameN-ethyl-N-[(E)-prop-1-enyl]acetamide
SMILESC/C=C/N(CC)C(C)=O
InChIInChI=1S/C7H13NO/c1-4-6-8(5-2)7(3)9/h4,6H,5H2,1-3H3/b6-4+
InChIKeyVQDRUXLXSHHYJT-GQCTYLIASA-N
XLogP1.39
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(E)-prop-1-enyl]acetamide?
The IUPAC name of N-ethyl-N-[(E)-prop-1-enyl]acetamide (CID 22363792) is N-ethyl-N-[(E)-prop-1-enyl]acetamide.
What is the SMILES notation for N-ethyl-N-[(E)-prop-1-enyl]acetamide?
The canonical SMILES for N-ethyl-N-[(E)-prop-1-enyl]acetamide is C/C=C/N(CC)C(C)=O.
What is the InChIKey of N-ethyl-N-[(E)-prop-1-enyl]acetamide?
The InChIKey is VQDRUXLXSHHYJT-GQCTYLIASA-N. The full InChI is InChI=1S/C7H13NO/c1-4-6-8(5-2)7(3)9/h4,6H,5H2,1-3H3/b6-4+.
What are the key properties of N-ethyl-N-[(E)-prop-1-enyl]acetamide?
N-ethyl-N-[(E)-prop-1-enyl]acetamide has a molecular weight of 127.19 g/mol, XLogP of 1.39, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(E)-prop-1-enyl]acetamide is sourced from PubChem (CID 22363792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).