N-ethyl-2,5,6-trimethylnon-4-en-3-imine

C14H27N — CID 123238622

IUPACN-ethyl-2,5,6-trimethylnon-4-en-3-imine
SMILESCCCC(C)C(C)=C/C(=N/CC)C(C)C
InChIInChI=1S/C14H27N/c1-7-9-12(5)13(6)10-14(11(3)4)15-8-2/h10-12H,7-9H2,1-6H3/b13-10?,15-14-
InChIKeyBEURIFNRPWPTBX-RWZQFZIVSA-N
MW209.38 g/mol
LogP4.49
Rot. Bonds6

About N-ethyl-2,5,6-trimethylnon-4-en-3-imine

N-ethyl-2,5,6-trimethylnon-4-en-3-imine (PubChem CID 123238622) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is N-ethyl-2,5,6-trimethylnon-4-en-3-imine.

Molecular Properties

Compound NameN-ethyl-2,5,6-trimethylnon-4-en-3-imine
PubChem CID123238622
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC NameN-ethyl-2,5,6-trimethylnon-4-en-3-imine
SMILESCCCC(C)C(C)=C/C(=N/CC)C(C)C
InChIInChI=1S/C14H27N/c1-7-9-12(5)13(6)10-14(11(3)4)15-8-2/h10-12H,7-9H2,1-6H3/b13-10?,15-14-
InChIKeyBEURIFNRPWPTBX-RWZQFZIVSA-N
XLogP4.49
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(Z)-N-ethyl-7-methyl-6-(trifluoromethyl)oct-2-en-4-imine
CID 166470434
(5S)-N-ethyl-7-fluoro-5,6-dimethylcyclohept-2-en-1-imine
CID 173683200
Ethyl-(3,5,5-trimethyl-cyclohex-2-enylidene)-amine
CID 11205971
3,5,5-trimethyl-N-(2-methylpropyl)cyclohex-2-en-1-imine
CID 70516911
N,2,5,5-tetramethylcyclohex-2-en-1-imine
CID 86038796
(1Z)-3,5,5-Trimethyl-N-(prop-2-en-1-yl)cyclohex-2-en-1-imine
CID 238062
(4E)-2,2,5-trimethyl-4-(2-methylpropylidene)-3H-pyrrole
CID 23252301
N-tert-butyl-3,7-dimethyloct-6-en-1-imine
CID 20591843
N-methyl-3,4-di(propan-2-yl)cyclohex-2-en-1-imine
CID 20631046
2,5-dimethyl-N,4-di(propan-2-yl)hex-4-en-3-imine
CID 20647017
4,5-di(propan-2-yl)-2H-pyrrole
CID 22891060
2,3,5-tri(propan-2-yl)-2H-pyrrole
CID 58164648

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,5,6-trimethylnon-4-en-3-imine?
The IUPAC name of N-ethyl-2,5,6-trimethylnon-4-en-3-imine (CID 123238622) is N-ethyl-2,5,6-trimethylnon-4-en-3-imine.
What is the SMILES notation for N-ethyl-2,5,6-trimethylnon-4-en-3-imine?
The canonical SMILES for N-ethyl-2,5,6-trimethylnon-4-en-3-imine is CCCC(C)C(C)=C/C(=N/CC)C(C)C.
What is the InChIKey of N-ethyl-2,5,6-trimethylnon-4-en-3-imine?
The InChIKey is BEURIFNRPWPTBX-RWZQFZIVSA-N. The full InChI is InChI=1S/C14H27N/c1-7-9-12(5)13(6)10-14(11(3)4)15-8-2/h10-12H,7-9H2,1-6H3/b13-10?,15-14-.
What are the key properties of N-ethyl-2,5,6-trimethylnon-4-en-3-imine?
N-ethyl-2,5,6-trimethylnon-4-en-3-imine has a molecular weight of 209.38 g/mol, XLogP of 4.49, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,5,6-trimethylnon-4-en-3-imine is sourced from PubChem (CID 123238622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).