(4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine

C10H18N2 — CID 163749175

IUPAC(4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine
SMILESC=C(C)C(C)(N)/C=C\C=N\CC
InChIInChI=1S/C10H18N2/c1-5-12-8-6-7-10(4,11)9(2)3/h6-8H,2,5,11H2,1,3-4H3/b7-6-,12-8+
InChIKeyLOMYQIWDKCNACS-UGLNBITBSA-N
MW166.27 g/mol
LogP1.93
Rot. Bonds4

About (4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine

(4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine (PubChem CID 163749175) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is (4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine.

Molecular Properties

Compound Name(4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine
PubChem CID163749175
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name(4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine
SMILESC=C(C)C(C)(N)/C=C\C=N\CC
InChIInChI=1S/C10H18N2/c1-5-12-8-6-7-10(4,11)9(2)3/h6-8H,2,5,11H2,1,3-4H3/b7-6-,12-8+
InChIKeyLOMYQIWDKCNACS-UGLNBITBSA-N
XLogP1.93
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2E,5E)-N-tert-butyl-3,7-dimethylocta-2,5-dien-1-imine
CID 135053282
3-Amino-3-methylpyridine
CID 89174215
(Z)-1-N-ethyl-2-N-methyl-6-methylidenehept-3-ene-1,2,7-triimine
CID 123329124
2-Methyl-2-prop-2-enylpyrrole
CID 123365814
2,3-Dimethyl-5-methyliminopent-3-en-2-amine
CID 123378299
4,7,7-trimethyl-3H-azepin-4-amine
CID 123535887
(Z,2Z)-2-ethylidene-3-N-methylhex-4-ene-1,3-diimine
CID 123844789
(Z)-N-tert-butyl-4-methylhex-2-en-1-imine
CID 138484906
(E)-3-ethenyl-5-methyliminopent-3-en-2-amine
CID 138703068
1-N-[(Z)-2-methylpent-3-en-2-yl]propane-1,2-diimine
CID 141810479
(Z)-N-(1-imino-2-methylpropan-2-yl)-4-methylpent-2-en-1-imine
CID 142986466
(3Z)-2,2,6-trimethyl-5H-azocine
CID 143216330

Frequently Asked Questions

What is the IUPAC name of (4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine?
The IUPAC name of (4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine (CID 163749175) is (4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine.
What is the SMILES notation for (4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine?
The canonical SMILES for (4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine is C=C(C)C(C)(N)/C=C\C=N\CC.
What is the InChIKey of (4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine?
The InChIKey is LOMYQIWDKCNACS-UGLNBITBSA-N. The full InChI is InChI=1S/C10H18N2/c1-5-12-8-6-7-10(4,11)9(2)3/h6-8H,2,5,11H2,1,3-4H3/b7-6-,12-8+.
What are the key properties of (4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine?
(4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine has a molecular weight of 166.27 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-6-ethylimino-2,3-dimethylhexa-1,4-dien-3-amine is sourced from PubChem (CID 163749175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).