(E)-4-ethenyliminohex-2-en-2-amine

C8H14N2 — CID 89277427

IUPAC(E)-4-ethenyliminohex-2-en-2-amine
SMILESC=C/N=C(/C=C(\C)N)CC
InChIInChI=1S/C8H14N2/c1-4-8(10-5-2)6-7(3)9/h5-6H,2,4,9H2,1,3H3/b7-6+,10-8+
InChIKeyINJWSHRQDAYJRR-LQPGMRSMSA-N
MW138.21 g/mol
LogP1.84
Rot. Bonds3

About (E)-4-ethenyliminohex-2-en-2-amine

(E)-4-ethenyliminohex-2-en-2-amine (PubChem CID 89277427) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is (E)-4-ethenyliminohex-2-en-2-amine.

Molecular Properties

Compound Name(E)-4-ethenyliminohex-2-en-2-amine
PubChem CID89277427
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name(E)-4-ethenyliminohex-2-en-2-amine
SMILESC=C/N=C(/C=C(\C)N)CC
InChIInChI=1S/C8H14N2/c1-4-8(10-5-2)6-7(3)9/h5-6H,2,4,9H2,1,3H3/b7-6+,10-8+
InChIKeyINJWSHRQDAYJRR-LQPGMRSMSA-N
XLogP1.84
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-5-fluoro-4-methyliminohex-2-en-2-amine
CID 172586650
(Z)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-amine
CID 11194331
2-[(Z)-but-1-enyl]-3H-pyrrole
CID 59879717
(2E,6Z,9E,13Z)-5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-2,4,6,9,11,13-hexaene
CID 69478667
(2Z,6Z,9Z,13Z)-5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-2,4,6,9,11,13-hexaene
CID 69478668
5,7,12,14-Tetramethyl-1,4,8,11-tetrazacyclotetradeca-2,4,6,9,11,13-hexaene
CID 69478671
1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-amine
CID 85431210
(Z)-4-methyliminopent-2-en-2-amine
CID 87688896
(Z)-2-[[(Z)-pent-3-en-2-ylidene]amino]prop-1-en-1-amine
CID 88874704
(Z)-4-[(Z)-prop-1-enyl]iminopent-2-en-2-amine
CID 88874705
(Z)-1-(but-3-en-2-ylideneamino)prop-1-en-2-amine
CID 88903194
(Z)-1-(pent-1-en-3-ylideneamino)prop-1-en-2-amine
CID 88987029

Frequently Asked Questions

What is the IUPAC name of (E)-4-ethenyliminohex-2-en-2-amine?
The IUPAC name of (E)-4-ethenyliminohex-2-en-2-amine (CID 89277427) is (E)-4-ethenyliminohex-2-en-2-amine.
What is the SMILES notation for (E)-4-ethenyliminohex-2-en-2-amine?
The canonical SMILES for (E)-4-ethenyliminohex-2-en-2-amine is C=C/N=C(/C=C(\C)N)CC.
What is the InChIKey of (E)-4-ethenyliminohex-2-en-2-amine?
The InChIKey is INJWSHRQDAYJRR-LQPGMRSMSA-N. The full InChI is InChI=1S/C8H14N2/c1-4-8(10-5-2)6-7(3)9/h5-6H,2,4,9H2,1,3H3/b7-6+,10-8+.
What are the key properties of (E)-4-ethenyliminohex-2-en-2-amine?
(E)-4-ethenyliminohex-2-en-2-amine has a molecular weight of 138.21 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-ethenyliminohex-2-en-2-amine is sourced from PubChem (CID 89277427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).