(5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane

C10H21N3 — CID 143395928

IUPAC(5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane
SMILESCC.CC.NN/N=C1/C=CC=CC1
InChIInChI=1S/C6H9N3.2C2H6/c7-9-8-6-4-2-1-3-5-6;2*1-2/h1-4,9H,5,7H2;2*1-2H3/b8-6-;;
InChIKeyQJYQWKDOQHDHBT-OTDBEEGXSA-N
MW183.30 g/mol
LogP2.37
Rot. Bonds1

About (5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane

(5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane (PubChem CID 143395928) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is (5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane.

Molecular Properties

Compound Name(5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane
PubChem CID143395928
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name(5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane
SMILESCC.CC.NN/N=C1/C=CC=CC1
InChIInChI=1S/C6H9N3.2C2H6/c7-9-8-6-4-2-1-3-5-6;2*1-2/h1-4,9H,5,7H2;2*1-2H3/b8-6-;;
InChIKeyQJYQWKDOQHDHBT-OTDBEEGXSA-N
XLogP2.37
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(E)-cyclohexa-2,4-dien-1-ylideneamino]-2,4-dimethylazetidin-1-amine
CID 89384811
N-[(E)-cyclohexa-2,4-dien-1-ylideneamino]-1,3,4-thiadiazol-2-amine
CID 21152361
N'-amino-N'-[(E)-cyclohexa-2,4-dien-1-ylideneamino]ethane-1,2-diamine
CID 143513033
cyclohepta-1,3,5-triene-1,2-diamine
CID 163640522
cyclohexa-2,4-dien-1-one;methanesulfonohydrazide
CID 174750849
N-(3-methylphenyl)cyclohexa-2,4-dien-1-imine
CID 163697540
ethane;2-(2-fluorocyclohepta-1,4,6-trien-1-yl)ethanamine
CID 143109921
hydrazine;5-sulfonylcyclohexa-1,3-diene
CID 172693673
5-diazocyclohexa-1,3-diene;formohydrazide
CID 158790941
[(E)-cycloocta-2,6-dien-1-ylideneamino]urea
CID 129403766
5-methylidenecyclohexa-1,3-diene;dihydrobromide
CID 175171179
cyclohexadeca-2,4,6,8,10,12,14-heptaen-1-one
CID 123633481

Frequently Asked Questions

What is the IUPAC name of (5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane?
The IUPAC name of (5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane (CID 143395928) is (5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane.
What is the SMILES notation for (5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane?
The canonical SMILES for (5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane is CC.CC.NN/N=C1/C=CC=CC1.
What is the InChIKey of (5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane?
The InChIKey is QJYQWKDOQHDHBT-OTDBEEGXSA-N. The full InChI is InChI=1S/C6H9N3.2C2H6/c7-9-8-6-4-2-1-3-5-6;2*1-2/h1-4,9H,5,7H2;2*1-2H3/b8-6-;;.
What are the key properties of (5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane?
(5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane has a molecular weight of 183.30 g/mol, XLogP of 2.37, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-(aminohydrazinylidene)cyclohexa-1,3-diene;ethane is sourced from PubChem (CID 143395928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).