N-(3,6-dimethylhept-1-en-3-yl)methanimine

C10H19N — CID 142048327

IUPACN-(3,6-dimethylhept-1-en-3-yl)methanimine
SMILESC=CC(C)(CCC(C)C)N=C
InChIInChI=1S/C10H19N/c1-6-10(4,11-5)8-7-9(2)3/h6,9H,1,5,7-8H2,2-4H3
InChIKeyFCRDVGVGEVBADG-UHFFFAOYSA-N
MW153.27 g/mol
LogP3.07
Rot. Bonds5

About N-(3,6-dimethylhept-1-en-3-yl)methanimine

N-(3,6-dimethylhept-1-en-3-yl)methanimine (PubChem CID 142048327) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is N-(3,6-dimethylhept-1-en-3-yl)methanimine.

Molecular Properties

Compound NameN-(3,6-dimethylhept-1-en-3-yl)methanimine
PubChem CID142048327
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC NameN-(3,6-dimethylhept-1-en-3-yl)methanimine
SMILESC=CC(C)(CCC(C)C)N=C
InChIInChI=1S/C10H19N/c1-6-10(4,11-5)8-7-9(2)3/h6,9H,1,5,7-8H2,2-4H3
InChIKeyFCRDVGVGEVBADG-UHFFFAOYSA-N
XLogP3.07
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,5-dimethylhexan-2-ol;ethene
CID 144803935
3,6-dimethylhept-1-en-3-yl acetate
CID 154263841
7,7,10-trimethylundec-1-ene
CID 173422023
1-(2,6-dichlorophenyl)-N-(3,7-dimethyloct-1-en-3-yl)methanimine
CID 175609254
2,5,8-trimethylnonan-5-ol
CID 58574498
2,8-dimethyl-5-(3-methylbutyl)-5-(2-methylpropyl)nonane
CID 158412329
N-(3,7-dimethyloct-1-en-3-yl)-1-(2-fluorophenyl)methanimine
CID 175609255
tris(2,8-dimethyl-5-(3-methylbutyl)-5-(2-methylpropyl)nonane);methane
CID 167580098
N-(2,4,6-trimethylheptan-4-yl)methanimine
CID 142214459
N-(2,4-dimethylpentan-2-yl)methanimine
CID 146407592
N-(3,6-dimethylheptan-3-yl)ethanimine
CID 123603789
3-ethenyl-2,2-dimethyl-N-(2-methylpropyl)hexan-1-imine
CID 11820414

Frequently Asked Questions

What is the IUPAC name of N-(3,6-dimethylhept-1-en-3-yl)methanimine?
The IUPAC name of N-(3,6-dimethylhept-1-en-3-yl)methanimine (CID 142048327) is N-(3,6-dimethylhept-1-en-3-yl)methanimine.
What is the SMILES notation for N-(3,6-dimethylhept-1-en-3-yl)methanimine?
The canonical SMILES for N-(3,6-dimethylhept-1-en-3-yl)methanimine is C=CC(C)(CCC(C)C)N=C.
What is the InChIKey of N-(3,6-dimethylhept-1-en-3-yl)methanimine?
The InChIKey is FCRDVGVGEVBADG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-6-10(4,11-5)8-7-9(2)3/h6,9H,1,5,7-8H2,2-4H3.
What are the key properties of N-(3,6-dimethylhept-1-en-3-yl)methanimine?
N-(3,6-dimethylhept-1-en-3-yl)methanimine has a molecular weight of 153.27 g/mol, XLogP of 3.07, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,6-dimethylhept-1-en-3-yl)methanimine is sourced from PubChem (CID 142048327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).