6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine

C15H25N — CID 91447041

IUPAC6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine
SMILES[H]/N=C1\CC(C)CCC=C1C1(C)CC1C(C)C
InChIInChI=1S/C15H25N/c1-10(2)13-9-15(13,4)12-7-5-6-11(3)8-14(12)16/h7,10-11,13,16H,5-6,8-9H2,1-4H3/b16-14+
InChIKeyWSLQECYRMZHBDT-JQIJEIRASA-N
MW219.37 g/mol
LogP4.43
Rot. Bonds2

About 6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine

6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine (PubChem CID 91447041) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine.

Molecular Properties

Compound Name6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine
PubChem CID91447041
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine
SMILES[H]/N=C1\CC(C)CCC=C1C1(C)CC1C(C)C
InChIInChI=1S/C15H25N/c1-10(2)13-9-15(13,4)12-7-5-6-11(3)8-14(12)16/h7,10-11,13,16H,5-6,8-9H2,1-4H3/b16-14+
InChIKeyWSLQECYRMZHBDT-JQIJEIRASA-N
XLogP4.43
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-Tert-butyl-4,5,7-trimethylnon-6-en-3-imine
CID 91135805
5-Ethyl-2-(3-methylheptan-2-yl)cyclohepta-2,6-dien-1-imine
CID 91205691
6-Ethylbicyclo[5.1.0]oct-4-en-3-imine
CID 91291120
4-(2,2,3,4-Tetramethylpentyl)cyclohex-2-en-1-imine
CID 91445250
1-Cyclopropyl-3-(2-methylpropyl)oct-2-en-1-imine
CID 91503531
1-Cyclopropyl-8-methylnon-7-en-2-imine
CID 91585531
1-[2-(3-Ethylheptyl)cycloprop-2-en-1-yl]propan-2-imine
CID 118396529
(3R)-3,5,5-trimethyl-1-(2-methylcycloprop-2-en-1-yl)hexan-2-imine
CID 121480625
3,9,10,13-Tetramethyl-6-methylidene-8-(5,5,6-trimethylheptan-2-yl)pentadeca-2,13-dien-7-imine
CID 123216111
7-Ethyl-3,5,5-trimethylcyclohept-2-en-1-imine
CID 123236420
2,5-Dimethylcyclohept-2-en-1-imine
CID 123362687
2-Cyclopropyl-6,7-dimethyloct-6-en-3-imine
CID 123420612

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine?
The IUPAC name of 6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine (CID 91447041) is 6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine.
What is the SMILES notation for 6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine?
The canonical SMILES for 6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine is [H]/N=C1\CC(C)CCC=C1C1(C)CC1C(C)C.
What is the InChIKey of 6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine?
The InChIKey is WSLQECYRMZHBDT-JQIJEIRASA-N. The full InChI is InChI=1S/C15H25N/c1-10(2)13-9-15(13,4)12-7-5-6-11(3)8-14(12)16/h7,10-11,13,16H,5-6,8-9H2,1-4H3/b16-14+.
What are the key properties of 6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine?
6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine has a molecular weight of 219.37 g/mol, XLogP of 4.43, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(1-methyl-2-propan-2-ylcyclopropyl)cyclohept-2-en-1-imine is sourced from PubChem (CID 91447041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).