3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine

C17H26N2 — CID 67216503

IUPAC3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine
SMILESCC1=C/C(=N\CC(C)/N=C2/C=C(C)CCC2)CCC1
InChIInChI=1S/C17H26N2/c1-13-6-4-8-16(10-13)18-12-15(3)19-17-9-5-7-14(2)11-17/h10-11,15H,4-9,12H2,1-3H3/b18-16-,19-17+
InChIKeyOCEYGOKEUYVKGO-JQNBNMKOSA-N
MW258.41 g/mol
LogP4.52
Rot. Bonds3

About 3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine

3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine (PubChem CID 67216503) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine.

Molecular Properties

Compound Name3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine
PubChem CID67216503
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine
SMILESCC1=C/C(=N\CC(C)/N=C2/C=C(C)CCC2)CCC1
InChIInChI=1S/C17H26N2/c1-13-6-4-8-16(10-13)18-12-15(3)19-17-9-5-7-14(2)11-17/h10-11,15H,4-9,12H2,1-3H3/b18-16-,19-17+
InChIKeyOCEYGOKEUYVKGO-JQNBNMKOSA-N
XLogP4.52
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine with MolForge

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Related Compounds

1-(cyclohexen-1-yl)-N-cyclohexylethanimine
CID 11148422
1-(cyclohexen-1-yl)-N-cyclohexylpropan-1-imine
CID 86006548
4-diazo-N-ethyl-2-methylcyclohex-2-en-1-imine
CID 57304768
(2Z)-2-(2-methylpropylidene)-N-propan-2-ylcyclohexan-1-imine
CID 58375620
2-Methyl-2,3,4,7,8,9-hexahydropyrido[2,3-g]quinoline
CID 67877650
5-Butyl-6-methyl-2,3-dihydropyridine
CID 89109547
N,3-dimethylcyclohex-2-en-1-imine
CID 90782444
5,6-Diethyl-2,3-dihydropyridine
CID 90830451
(E)-N,3-dimethyloct-2-en-4-imine
CID 91148159
N-ethyl-3-ethylidenehexan-2-imine
CID 91288958
(Z)-N-butan-2-yl-4-ethylhex-4-en-3-imine
CID 118616225
N,4-diethyl-3,6-dimethylocta-3,6-dien-2-imine
CID 123213571

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine?
The IUPAC name of 3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine (CID 67216503) is 3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine.
What is the SMILES notation for 3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine?
The canonical SMILES for 3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine is CC1=C/C(=N\CC(C)/N=C2/C=C(C)CCC2)CCC1.
What is the InChIKey of 3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine?
The InChIKey is OCEYGOKEUYVKGO-JQNBNMKOSA-N. The full InChI is InChI=1S/C17H26N2/c1-13-6-4-8-16(10-13)18-12-15(3)19-17-9-5-7-14(2)11-17/h10-11,15H,4-9,12H2,1-3H3/b18-16-,19-17+.
What are the key properties of 3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine?
3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine has a molecular weight of 258.41 g/mol, XLogP of 4.52, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-[(3-methylcyclohex-2-en-1-ylidene)amino]propyl]cyclohex-2-en-1-imine is sourced from PubChem (CID 67216503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).