N-dec-6-enylbutan-1-imine

C14H27N — CID 91189971

IUPACN-dec-6-enylbutan-1-imine
SMILESCCCC=CCCCCC/N=C/CCC
InChIInChI=1S/C14H27N/c1-3-5-7-8-9-10-11-12-14-15-13-6-4-2/h7-8,13H,3-6,9-12,14H2,1-2H3/b8-7?,15-13+
InChIKeyWHDSSBFAIFRZBG-UIDWEYITSA-N
MW209.38 g/mol
LogP4.77
Rot. Bonds10

About N-dec-6-enylbutan-1-imine

N-dec-6-enylbutan-1-imine (PubChem CID 91189971) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is N-dec-6-enylbutan-1-imine.

Molecular Properties

Compound NameN-dec-6-enylbutan-1-imine
PubChem CID91189971
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC NameN-dec-6-enylbutan-1-imine
SMILESCCCC=CCCCCC/N=C/CCC
InChIInChI=1S/C14H27N/c1-3-5-7-8-9-10-11-12-14-15-13-6-4-2/h7-8,13H,3-6,9-12,14H2,1-2H3/b8-7?,15-13+
InChIKeyWHDSSBFAIFRZBG-UIDWEYITSA-N
XLogP4.77
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 54.77
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

Azacyclotetradeca-1,8-diene
CID 129657727
5-[(E)-hept-1-enyl]-3,4-dihydro-2H-pyrrole
CID 71531028
(E)-N,N'-dipentylpent-2-ene-1,5-diimine
CID 19025926
(4Z,8Z)-1-azacyclododeca-4,8,12-triene
CID 20405358
N-[(E)-dec-8-enyl]methanimine
CID 20714852
1-Azacyclododeca-4,8,12-triene
CID 53824618
N-methylicos-11-en-1-imine
CID 53865000
N,N'-dipentylpent-2-ene-1,5-diimine
CID 54354710
N-hexylhex-3-en-1-imine
CID 56985502
N-pentylhex-5-en-1-imine
CID 57013677
N-hept-4-en-2-yloctan-1-imine
CID 57114269
N-propylhex-2-en-1-imine
CID 57162826

Frequently Asked Questions

What is the IUPAC name of N-dec-6-enylbutan-1-imine?
The IUPAC name of N-dec-6-enylbutan-1-imine (CID 91189971) is N-dec-6-enylbutan-1-imine.
What is the SMILES notation for N-dec-6-enylbutan-1-imine?
The canonical SMILES for N-dec-6-enylbutan-1-imine is CCCC=CCCCCC/N=C/CCC.
What is the InChIKey of N-dec-6-enylbutan-1-imine?
The InChIKey is WHDSSBFAIFRZBG-UIDWEYITSA-N. The full InChI is InChI=1S/C14H27N/c1-3-5-7-8-9-10-11-12-14-15-13-6-4-2/h7-8,13H,3-6,9-12,14H2,1-2H3/b8-7?,15-13+.
What are the key properties of N-dec-6-enylbutan-1-imine?
N-dec-6-enylbutan-1-imine has a molecular weight of 209.38 g/mol, XLogP of 4.77, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-dec-6-enylbutan-1-imine is sourced from PubChem (CID 91189971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).