2-ethyl-6-methylhept-5-en-1-imine

C10H19N — CID 155247195

IUPAC2-ethyl-6-methylhept-5-en-1-imine
SMILES[H]/N=C/C(CC)CCC=C(C)C
InChIInChI=1S/C10H19N/c1-4-10(8-11)7-5-6-9(2)3/h6,8,10-11H,4-5,7H2,1-3H3/b11-8+
InChIKeySQMIKUTUKACHEJ-DHZHZOJOSA-N
MW153.27 g/mol
LogP3.41
Rot. Bonds5

About 2-ethyl-6-methylhept-5-en-1-imine

2-ethyl-6-methylhept-5-en-1-imine (PubChem CID 155247195) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 2-ethyl-6-methylhept-5-en-1-imine.

Molecular Properties

Compound Name2-ethyl-6-methylhept-5-en-1-imine
PubChem CID155247195
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name2-ethyl-6-methylhept-5-en-1-imine
SMILES[H]/N=C/C(CC)CCC=C(C)C
InChIInChI=1S/C10H19N/c1-4-10(8-11)7-5-6-9(2)3/h6,8,10-11H,4-5,7H2,1-3H3/b11-8+
InChIKeySQMIKUTUKACHEJ-DHZHZOJOSA-N
XLogP3.41
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 53.41
H-Bond Donors ≤ 51
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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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-methylhept-5-en-1-imine?
The IUPAC name of 2-ethyl-6-methylhept-5-en-1-imine (CID 155247195) is 2-ethyl-6-methylhept-5-en-1-imine.
What is the SMILES notation for 2-ethyl-6-methylhept-5-en-1-imine?
The canonical SMILES for 2-ethyl-6-methylhept-5-en-1-imine is [H]/N=C/C(CC)CCC=C(C)C.
What is the InChIKey of 2-ethyl-6-methylhept-5-en-1-imine?
The InChIKey is SQMIKUTUKACHEJ-DHZHZOJOSA-N. The full InChI is InChI=1S/C10H19N/c1-4-10(8-11)7-5-6-9(2)3/h6,8,10-11H,4-5,7H2,1-3H3/b11-8+.
What are the key properties of 2-ethyl-6-methylhept-5-en-1-imine?
2-ethyl-6-methylhept-5-en-1-imine has a molecular weight of 153.27 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-methylhept-5-en-1-imine is sourced from PubChem (CID 155247195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).