N-(6-methyl-5-methylidenehept-6-enyl)methanimine

C10H17N — CID 91160163

IUPACN-(6-methyl-5-methylidenehept-6-enyl)methanimine
SMILESC=NCCCCC(=C)C(=C)C
InChIInChI=1S/C10H17N/c1-9(2)10(3)7-5-6-8-11-4/h1,3-8H2,2H3
InChIKeyOGZSQZTUKQPGKR-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.99
Rot. Bonds6

About N-(6-methyl-5-methylidenehept-6-enyl)methanimine

N-(6-methyl-5-methylidenehept-6-enyl)methanimine (PubChem CID 91160163) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is N-(6-methyl-5-methylidenehept-6-enyl)methanimine.

Molecular Properties

Compound NameN-(6-methyl-5-methylidenehept-6-enyl)methanimine
PubChem CID91160163
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC NameN-(6-methyl-5-methylidenehept-6-enyl)methanimine
SMILESC=NCCCCC(=C)C(=C)C
InChIInChI=1S/C10H17N/c1-9(2)10(3)7-5-6-8-11-4/h1,3-8H2,2H3
InChIKeyOGZSQZTUKQPGKR-UHFFFAOYSA-N
XLogP2.99
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.99
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': 'polyene', 'substructure': 'N/A'}

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Related Compounds

N-(2-methylidenehexyl)methanimine
CID 89785528
N-(4-methyl-3-methylidenepent-4-enyl)methanimine
CID 123326935
N-(6-methylideneoctyl)ethanimine
CID 123581746
N-(4-methylidenehexan-2-yl)methanimine
CID 123941646
N-[(4Z)-4-ethyl-6-methylhepta-4,6-dienyl]methanimine
CID 129127018
N-(3-methylidenenonan-4-yl)methanimine
CID 130286484
N-(2-methyl-6-methylideneocta-1,7-dien-3-yl)methanimine
CID 139514343
N-[(4Z)-4-propylocta-4,6-dienyl]methanimine
CID 146585929
N-(2,8-dimethylnon-8-enyl)methanimine
CID 155202486
2-methyl-N-(6-methylhept-6-enyl)prop-2-en-1-imine
CID 167034799
N-(5,6-dimethylhept-6-enyl)methanimine
CID 168178474
N-(2-methylideneoctyl)methanimine
CID 102345884

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-5-methylidenehept-6-enyl)methanimine?
The IUPAC name of N-(6-methyl-5-methylidenehept-6-enyl)methanimine (CID 91160163) is N-(6-methyl-5-methylidenehept-6-enyl)methanimine.
What is the SMILES notation for N-(6-methyl-5-methylidenehept-6-enyl)methanimine?
The canonical SMILES for N-(6-methyl-5-methylidenehept-6-enyl)methanimine is C=NCCCCC(=C)C(=C)C.
What is the InChIKey of N-(6-methyl-5-methylidenehept-6-enyl)methanimine?
The InChIKey is OGZSQZTUKQPGKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-9(2)10(3)7-5-6-8-11-4/h1,3-8H2,2H3.
What are the key properties of N-(6-methyl-5-methylidenehept-6-enyl)methanimine?
N-(6-methyl-5-methylidenehept-6-enyl)methanimine has a molecular weight of 151.25 g/mol, XLogP of 2.99, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-5-methylidenehept-6-enyl)methanimine is sourced from PubChem (CID 91160163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).