ethane;2-hydrazinylbenzene-1,4-diamine

C10H22N4 — CID 142054755

IUPACethane;2-hydrazinylbenzene-1,4-diamine
SMILESCC.CC.NNc1cc(N)ccc1N
InChIInChI=1S/C6H10N4.2C2H6/c7-4-1-2-5(8)6(3-4)10-9;2*1-2/h1-3,10H,7-9H2;2*1-2H3
InChIKeyVMTYIYOTSZTDGF-UHFFFAOYSA-N
MW198.31 g/mol
LogP2.19
Rot. Bonds1

About ethane;2-hydrazinylbenzene-1,4-diamine

ethane;2-hydrazinylbenzene-1,4-diamine (PubChem CID 142054755) has the molecular formula C10H22N4 and a molecular weight of 198.31 g/mol. Its IUPAC name is ethane;2-hydrazinylbenzene-1,4-diamine.

Molecular Properties

Compound Nameethane;2-hydrazinylbenzene-1,4-diamine
PubChem CID142054755
Molecular FormulaC10H22N4
Molecular Weight198.31 g/mol
Exact Mass198.18
IUPAC Nameethane;2-hydrazinylbenzene-1,4-diamine
SMILESCC.CC.NNc1cc(N)ccc1N
InChIInChI=1S/C6H10N4.2C2H6/c7-4-1-2-5(8)6(3-4)10-9;2*1-2/h1-3,10H,7-9H2;2*1-2H3
InChIKeyVMTYIYOTSZTDGF-UHFFFAOYSA-N
XLogP2.19
TPSA90.09 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.19
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', '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;2-hydrazinylbenzene-1,4-diamine?
The IUPAC name of ethane;2-hydrazinylbenzene-1,4-diamine (CID 142054755) is ethane;2-hydrazinylbenzene-1,4-diamine.
What is the SMILES notation for ethane;2-hydrazinylbenzene-1,4-diamine?
The canonical SMILES for ethane;2-hydrazinylbenzene-1,4-diamine is CC.CC.NNc1cc(N)ccc1N.
What is the InChIKey of ethane;2-hydrazinylbenzene-1,4-diamine?
The InChIKey is VMTYIYOTSZTDGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4.2C2H6/c7-4-1-2-5(8)6(3-4)10-9;2*1-2/h1-3,10H,7-9H2;2*1-2H3.
What are the key properties of ethane;2-hydrazinylbenzene-1,4-diamine?
ethane;2-hydrazinylbenzene-1,4-diamine has a molecular weight of 198.31 g/mol, XLogP of 2.19, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-hydrazinylbenzene-1,4-diamine is sourced from PubChem (CID 142054755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).