N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide

C10H19NO — CID 139420295

IUPACN-ethyl-N-[(E)-hex-3-en-3-yl]acetamide
SMILESCC/C=C(\CC)N(CC)C(C)=O
InChIInChI=1S/C10H19NO/c1-5-8-10(6-2)11(7-3)9(4)12/h8H,5-7H2,1-4H3/b10-8+
InChIKeyUPNYHCZLHOSZLD-CSKARUKUSA-N
MW169.27 g/mol
LogP2.56
Rot. Bonds4

About N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide

N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide (PubChem CID 139420295) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide.

Molecular Properties

Compound NameN-ethyl-N-[(E)-hex-3-en-3-yl]acetamide
PubChem CID139420295
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-ethyl-N-[(E)-hex-3-en-3-yl]acetamide
SMILESCC/C=C(\CC)N(CC)C(C)=O
InChIInChI=1S/C10H19NO/c1-5-8-10(6-2)11(7-3)9(4)12/h8H,5-7H2,1-4H3/b10-8+
InChIKeyUPNYHCZLHOSZLD-CSKARUKUSA-N
XLogP2.56
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.56
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)-hex-3-en-3-yl]acetamide?
The IUPAC name of N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide (CID 139420295) is N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide.
What is the SMILES notation for N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide?
The canonical SMILES for N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide is CC/C=C(\CC)N(CC)C(C)=O.
What is the InChIKey of N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide?
The InChIKey is UPNYHCZLHOSZLD-CSKARUKUSA-N. The full InChI is InChI=1S/C10H19NO/c1-5-8-10(6-2)11(7-3)9(4)12/h8H,5-7H2,1-4H3/b10-8+.
What are the key properties of N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide?
N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide has a molecular weight of 169.27 g/mol, XLogP of 2.56, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(E)-hex-3-en-3-yl]acetamide is sourced from PubChem (CID 139420295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).