N,N-bis[(E)-hex-2-enyl]formamide

C13H23NO — CID 88551076

IUPACN,N-bis[(E)-hex-2-enyl]formamide
SMILESCCC/C=C/CN(C=O)C/C=C/CCC
InChIInChI=1S/C13H23NO/c1-3-5-7-9-11-14(13-15)12-10-8-6-4-2/h7-10,13H,3-6,11-12H2,1-2H3/b9-7+,10-8+
InChIKeyXAOKSZWLMHGNAJ-FIFLTTCUSA-N
MW209.33 g/mol
LogP3.16
Rot. Bonds9

About N,N-bis[(E)-hex-2-enyl]formamide

N,N-bis[(E)-hex-2-enyl]formamide (PubChem CID 88551076) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is N,N-bis[(E)-hex-2-enyl]formamide.

Molecular Properties

Compound NameN,N-bis[(E)-hex-2-enyl]formamide
PubChem CID88551076
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC NameN,N-bis[(E)-hex-2-enyl]formamide
SMILESCCC/C=C/CN(C=O)C/C=C/CCC
InChIInChI=1S/C13H23NO/c1-3-5-7-9-11-14(13-15)12-10-8-6-4-2/h7-10,13H,3-6,11-12H2,1-2H3/b9-7+,10-8+
InChIKeyXAOKSZWLMHGNAJ-FIFLTTCUSA-N
XLogP3.16
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-bis[(E)-hex-2-enyl]formamide?
The IUPAC name of N,N-bis[(E)-hex-2-enyl]formamide (CID 88551076) is N,N-bis[(E)-hex-2-enyl]formamide.
What is the SMILES notation for N,N-bis[(E)-hex-2-enyl]formamide?
The canonical SMILES for N,N-bis[(E)-hex-2-enyl]formamide is CCC/C=C/CN(C=O)C/C=C/CCC.
What is the InChIKey of N,N-bis[(E)-hex-2-enyl]formamide?
The InChIKey is XAOKSZWLMHGNAJ-FIFLTTCUSA-N. The full InChI is InChI=1S/C13H23NO/c1-3-5-7-9-11-14(13-15)12-10-8-6-4-2/h7-10,13H,3-6,11-12H2,1-2H3/b9-7+,10-8+.
What are the key properties of N,N-bis[(E)-hex-2-enyl]formamide?
N,N-bis[(E)-hex-2-enyl]formamide has a molecular weight of 209.33 g/mol, XLogP of 3.16, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[(E)-hex-2-enyl]formamide is sourced from PubChem (CID 88551076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).