1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine

C9H14N4 — CID 90848392

IUPAC1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine
SMILESC1=C(NNc2cnc[nH]2)CCCC1
InChIInChI=1S/C9H14N4/c1-2-4-8(5-3-1)12-13-9-6-10-7-11-9/h4,6-7,12-13H,1-3,5H2,(H,10,11)
InChIKeyNNNYTQDNOOSEOE-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.78
Rot. Bonds3

About 1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine

1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine (PubChem CID 90848392) has the molecular formula C9H14N4 and a molecular weight of 178.24 g/mol. Its IUPAC name is 1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine.

Molecular Properties

Compound Name1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine
PubChem CID90848392
Molecular FormulaC9H14N4
Molecular Weight178.24 g/mol
Exact Mass178.12
IUPAC Name1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine
SMILESC1=C(NNc2cnc[nH]2)CCCC1
InChIInChI=1S/C9H14N4/c1-2-4-8(5-3-1)12-13-9-6-10-7-11-9/h4,6-7,12-13H,1-3,5H2,(H,10,11)
InChIKeyNNNYTQDNOOSEOE-UHFFFAOYSA-N
XLogP1.78
TPSA52.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine?
The IUPAC name of 1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine (CID 90848392) is 1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine.
What is the SMILES notation for 1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine?
The canonical SMILES for 1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine is C1=C(NNc2cnc[nH]2)CCCC1.
What is the InChIKey of 1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine?
The InChIKey is NNNYTQDNOOSEOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4/c1-2-4-8(5-3-1)12-13-9-6-10-7-11-9/h4,6-7,12-13H,1-3,5H2,(H,10,11).
What are the key properties of 1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine?
1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine has a molecular weight of 178.24 g/mol, XLogP of 1.78, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexen-1-yl)-2-(1H-imidazol-5-yl)hydrazine is sourced from PubChem (CID 90848392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).