5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine

C10H16N2 — CID 91372737

IUPAC5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine
SMILES[H]/N=C/C1=CCC(CC)C(C)/C1=N\[H]
InChIInChI=1S/C10H16N2/c1-3-8-4-5-9(6-11)10(12)7(8)2/h5-8,11-12H,3-4H2,1-2H3/b11-6+,12-10+
InChIKeyXVHAVIIMYLZJFW-BFPRWLMKSA-N
MW164.25 g/mol
LogP2.65
Rot. Bonds2

About 5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine

5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine (PubChem CID 91372737) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine.

Molecular Properties

Compound Name5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine
PubChem CID91372737
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine
SMILES[H]/N=C/C1=CCC(CC)C(C)/C1=N\[H]
InChIInChI=1S/C10H16N2/c1-3-8-4-5-9(6-11)10(12)7(8)2/h5-8,11-12H,3-4H2,1-2H3/b11-6+,12-10+
InChIKeyXVHAVIIMYLZJFW-BFPRWLMKSA-N
XLogP2.65
TPSA47.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

3,5-Dimethylcyclohex-2-en-1-imine
CID 12562472
(Z)-5-methyl-3-propan-2-ylhex-2-ene-1,4-diimine
CID 88583469
2-(3,5-Dimethylcyclohex-3-en-1-yl)ethanimine
CID 89244763
2-(3,5-Dimethylcyclohex-3-en-1-yl)propan-1-imine
CID 89246740
7-Ethyl-3-methyl-2-methylidenenon-6-en-1-imine
CID 89282931
(Z)-4-methyl-2-propylhex-4-en-1-imine
CID 89697919
(2,4-Dimethylcyclohex-3-en-1-yl)methanimine
CID 89899175
(Z)-3-methyloct-5-ene-1,7-diimine
CID 90709896
(7Z)-7-ethylidene-2,3,8-trimethyldecane-1,6-diimine
CID 90917683
(6Z)-6-(4,5-dimethylhexan-3-ylidene)cyclohex-2-en-1-imine
CID 123201582
(3Z)-3-(2-ethylcyclohexylidene)propan-1-imine
CID 123302090
2,6-Dimethylcyclohex-2-en-1-imine
CID 123413356

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine?
The IUPAC name of 5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine (CID 91372737) is 5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine.
What is the SMILES notation for 5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine?
The canonical SMILES for 5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine is [H]/N=C/C1=CCC(CC)C(C)/C1=N\[H].
What is the InChIKey of 5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine?
The InChIKey is XVHAVIIMYLZJFW-BFPRWLMKSA-N. The full InChI is InChI=1S/C10H16N2/c1-3-8-4-5-9(6-11)10(12)7(8)2/h5-8,11-12H,3-4H2,1-2H3/b11-6+,12-10+.
What are the key properties of 5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine?
5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine has a molecular weight of 164.25 g/mol, XLogP of 2.65, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methanimidoyl-6-methylcyclohex-2-en-1-imine is sourced from PubChem (CID 91372737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).