N-(5-methyl-4-methylidenehexyl)ethanimine

C10H19N — CID 163663275

IUPACN-(5-methyl-4-methylidenehexyl)ethanimine
SMILESC=C(CCC/N=C/C)C(C)C
InChIInChI=1S/C10H19N/c1-5-11-8-6-7-10(4)9(2)3/h5,9H,4,6-8H2,1-3H3/b11-5+
InChIKeyIWFDNGDGHKDKPM-VZUCSPMQSA-N
MW153.27 g/mol
LogP3.07
Rot. Bonds5

About N-(5-methyl-4-methylidenehexyl)ethanimine

N-(5-methyl-4-methylidenehexyl)ethanimine (PubChem CID 163663275) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is N-(5-methyl-4-methylidenehexyl)ethanimine.

Molecular Properties

Compound NameN-(5-methyl-4-methylidenehexyl)ethanimine
PubChem CID163663275
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC NameN-(5-methyl-4-methylidenehexyl)ethanimine
SMILESC=C(CCC/N=C/C)C(C)C
InChIInChI=1S/C10H19N/c1-5-11-8-6-7-10(4)9(2)3/h5,9H,4,6-8H2,1-3H3/b11-5+
InChIKeyIWFDNGDGHKDKPM-VZUCSPMQSA-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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-(2-methylpent-1-enyl)pentan-1-imine
CID 54531657
N-(2-cyclopentylprop-2-enyl)ethanimine;tungsten
CID 58696114
N-(2-ethenyl-3-methylpentyl)ethanimine
CID 91222977
N-(2-ethyl-4-methylpent-4-enyl)-1-(2-methylcyclopropyl)methanimine
CID 123433831
N-(6-methylideneoctyl)ethanimine
CID 123581746
N-(2,5-dimethyl-3-propylidenehept-5-enyl)-2-methylpropan-1-imine
CID 123745403
2,2-dimethyl-4-prop-1-en-2-yl-4,5-dihydro-3H-pyridine
CID 124015226
N-[(E)-2,4-dimethylpent-1-enyl]ethanimine
CID 129210036
N-(4-methyl-3-methylidenehexan-2-yl)ethanimine
CID 137536264
N-(5-methylidene-3-propan-2-ylhept-6-enyl)ethanimine
CID 139406340
N-[(2R)-2,4-dimethylhexyl]-2-methylidenebutan-1-imine
CID 139551304
N-(2,4-dimethylpent-4-enyl)methanimine;ethane
CID 143707442

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-4-methylidenehexyl)ethanimine?
The IUPAC name of N-(5-methyl-4-methylidenehexyl)ethanimine (CID 163663275) is N-(5-methyl-4-methylidenehexyl)ethanimine.
What is the SMILES notation for N-(5-methyl-4-methylidenehexyl)ethanimine?
The canonical SMILES for N-(5-methyl-4-methylidenehexyl)ethanimine is C=C(CCC/N=C/C)C(C)C.
What is the InChIKey of N-(5-methyl-4-methylidenehexyl)ethanimine?
The InChIKey is IWFDNGDGHKDKPM-VZUCSPMQSA-N. The full InChI is InChI=1S/C10H19N/c1-5-11-8-6-7-10(4)9(2)3/h5,9H,4,6-8H2,1-3H3/b11-5+.
What are the key properties of N-(5-methyl-4-methylidenehexyl)ethanimine?
N-(5-methyl-4-methylidenehexyl)ethanimine 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-(5-methyl-4-methylidenehexyl)ethanimine is sourced from PubChem (CID 163663275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).