[1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine

C16H28N4 — CID 105308403

IUPAC[1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine
SMILESCCn1ccnc1C(NN)C1CCC2CCCCC2C1
InChIInChI=1S/C16H28N4/c1-2-20-10-9-18-16(20)15(19-17)14-8-7-12-5-3-4-6-13(12)11-14/h9-10,12-15,19H,2-8,11,17H2,1H3
InChIKeyCLCDHEUIKMXLAH-UHFFFAOYSA-N
MW276.43 g/mol
LogP3.01
Rot. Bonds4

About [1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine

[1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine (PubChem CID 105308403) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is [1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine
PubChem CID105308403
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC Name[1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine
SMILESCCn1ccnc1C(NN)C1CCC2CCCCC2C1
InChIInChI=1S/C16H28N4/c1-2-20-10-9-18-16(20)15(19-17)14-8-7-12-5-3-4-6-13(12)11-14/h9-10,12-15,19H,2-8,11,17H2,1H3
InChIKeyCLCDHEUIKMXLAH-UHFFFAOYSA-N
XLogP3.01
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[(1-ethylimidazol-2-yl)-(3-methylcyclopentyl)methyl]hydrazine
CID 105233058
1-(3-ethylcyclopentyl)-1-(1-ethylimidazol-2-yl)-N-methylmethanamine
CID 65410037
[(1-propylimidazol-2-yl)-(3-tricyclo[3.2.1.02,4]octanyl)methyl]hydrazine
CID 114097461
[(1-ethylimidazol-2-yl)-(2-methyloxolan-3-yl)methyl]hydrazine
CID 105308429
2-cycloheptyl-1-(1-ethylimidazol-2-yl)-N-methylethanamine
CID 115860135
[1-cycloheptyl-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105232129
1-(1-ethylimidazol-2-yl)-N-methyl-1-(4-propylcyclohexyl)methanamine
CID 65423382
1-cyclopropyl-2-(1-ethylimidazol-2-yl)ethane-1,2-diol
CID 103456993
2-cyclopentylsulfanyl-1-(1-ethylimidazol-2-yl)ethanamine
CID 65138714
[1-cyclopentylsulfanyl-3-(1-ethylimidazol-2-yl)propan-2-yl]hydrazine
CID 105227664
1-cyclooctyl-N-methyl-1-(1-propylimidazol-2-yl)methanamine
CID 80603549
N-[(4-butylcyclohexyl)-(1-ethylimidazol-2-yl)methyl]ethanamine
CID 115860125

Frequently Asked Questions

What is the IUPAC name of [1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine?
The IUPAC name of [1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine (CID 105308403) is [1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine.
What is the SMILES notation for [1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine?
The canonical SMILES for [1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine is CCn1ccnc1C(NN)C1CCC2CCCCC2C1.
What is the InChIKey of [1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine?
The InChIKey is CLCDHEUIKMXLAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-2-20-10-9-18-16(20)15(19-17)14-8-7-12-5-3-4-6-13(12)11-14/h9-10,12-15,19H,2-8,11,17H2,1H3.
What are the key properties of [1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine?
[1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine has a molecular weight of 276.43 g/mol, XLogP of 3.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl-(1-ethylimidazol-2-yl)methyl]hydrazine is sourced from PubChem (CID 105308403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).