ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine

C10H19N3 — CID 143630973

IUPACethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine
SMILESCC.CC1=C/C(=N/N)C(N)C=C1C
InChIInChI=1S/C8H13N3.C2H6/c1-5-3-7(9)8(11-10)4-6(5)2;1-2/h3-4,7H,9-10H2,1-2H3;1-2H3/b11-8-;
InChIKeyUFJOYSZBLZPTRH-MKFZHGHUSA-N
MW181.28 g/mol
LogP1.56
Rot. Bonds

About ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine

ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine (PubChem CID 143630973) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine.

Molecular Properties

Compound Nameethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine
PubChem CID143630973
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Nameethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine
SMILESCC.CC1=C/C(=N/N)C(N)C=C1C
InChIInChI=1S/C8H13N3.C2H6/c1-5-3-7(9)8(11-10)4-6(5)2;1-2/h3-4,7H,9-10H2,1-2H3;1-2H3/b11-8-;
InChIKeyUFJOYSZBLZPTRH-MKFZHGHUSA-N
XLogP1.56
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.56
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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Frequently Asked Questions

What is the IUPAC name of ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine?
The IUPAC name of ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine (CID 143630973) is ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine.
What is the SMILES notation for ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine?
The canonical SMILES for ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine is CC.CC1=C/C(=N/N)C(N)C=C1C.
What is the InChIKey of ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine?
The InChIKey is UFJOYSZBLZPTRH-MKFZHGHUSA-N. The full InChI is InChI=1S/C8H13N3.C2H6/c1-5-3-7(9)8(11-10)4-6(5)2;1-2/h3-4,7H,9-10H2,1-2H3;1-2H3/b11-8-;.
What are the key properties of ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine?
ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine has a molecular weight of 181.28 g/mol, XLogP of 1.56, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(6Z)-6-hydrazinylidene-3,4-dimethylcyclohexa-2,4-dien-1-amine is sourced from PubChem (CID 143630973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).