(E)-1-(ethylideneamino)hex-1-en-2-amine

C8H16N2 — CID 155480222

IUPAC(E)-1-(ethylideneamino)hex-1-en-2-amine
SMILESC/C=N/C=C(/N)CCCC
InChIInChI=1S/C8H16N2/c1-3-5-6-8(9)7-10-4-2/h4,7H,3,5-6,9H2,1-2H3/b8-7+,10-4+
InChIKeyOXCCZXPBKXVSBD-IJKCFHSJSA-N
MW140.23 g/mol
LogP2.07
Rot. Bonds4

About (E)-1-(ethylideneamino)hex-1-en-2-amine

(E)-1-(ethylideneamino)hex-1-en-2-amine (PubChem CID 155480222) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (E)-1-(ethylideneamino)hex-1-en-2-amine.

Molecular Properties

Compound Name(E)-1-(ethylideneamino)hex-1-en-2-amine
PubChem CID155480222
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(E)-1-(ethylideneamino)hex-1-en-2-amine
SMILESC/C=N/C=C(/N)CCCC
InChIInChI=1S/C8H16N2/c1-3-5-6-8(9)7-10-4-2/h4,7H,3,5-6,9H2,1-2H3/b8-7+,10-4+
InChIKeyOXCCZXPBKXVSBD-IJKCFHSJSA-N
XLogP2.07
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-1-(ethylideneamino)hex-1-en-2-amine?
The IUPAC name of (E)-1-(ethylideneamino)hex-1-en-2-amine (CID 155480222) is (E)-1-(ethylideneamino)hex-1-en-2-amine.
What is the SMILES notation for (E)-1-(ethylideneamino)hex-1-en-2-amine?
The canonical SMILES for (E)-1-(ethylideneamino)hex-1-en-2-amine is C/C=N/C=C(/N)CCCC.
What is the InChIKey of (E)-1-(ethylideneamino)hex-1-en-2-amine?
The InChIKey is OXCCZXPBKXVSBD-IJKCFHSJSA-N. The full InChI is InChI=1S/C8H16N2/c1-3-5-6-8(9)7-10-4-2/h4,7H,3,5-6,9H2,1-2H3/b8-7+,10-4+.
What are the key properties of (E)-1-(ethylideneamino)hex-1-en-2-amine?
(E)-1-(ethylideneamino)hex-1-en-2-amine has a molecular weight of 140.23 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(ethylideneamino)hex-1-en-2-amine is sourced from PubChem (CID 155480222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).