N,7-dimethyl-3-propan-2-ylnon-3-en-2-imine

C14H27N — CID 123671847

IUPACN,7-dimethyl-3-propan-2-ylnon-3-en-2-imine
SMILESCCC(C)CCC=C(/C(C)=N/C)C(C)C
InChIInChI=1S/C14H27N/c1-7-12(4)9-8-10-14(11(2)3)13(5)15-6/h10-12H,7-9H2,1-6H3/b14-10?,15-13+
InChIKeyCFHWDRAGXPULQG-QENBWMSWSA-N
MW209.38 g/mol
LogP4.49
Rot. Bonds6

About N,7-dimethyl-3-propan-2-ylnon-3-en-2-imine

N,7-dimethyl-3-propan-2-ylnon-3-en-2-imine (PubChem CID 123671847) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is N,7-dimethyl-3-propan-2-ylnon-3-en-2-imine.

Molecular Properties

Compound NameN,7-dimethyl-3-propan-2-ylnon-3-en-2-imine
PubChem CID123671847
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC NameN,7-dimethyl-3-propan-2-ylnon-3-en-2-imine
SMILESCCC(C)CCC=C(/C(C)=N/C)C(C)C
InChIInChI=1S/C14H27N/c1-7-12(4)9-8-10-14(11(2)3)13(5)15-6/h10-12H,7-9H2,1-6H3/b14-10?,15-13+
InChIKeyCFHWDRAGXPULQG-QENBWMSWSA-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

6-fluoro-N,4-dimethylcyclohex-2-en-1-imine
CID 123297893
1-[(5S)-4-ethyl-5-fluorocyclohex-3-en-1-yl]-N-methylethanimine
CID 126545859
(E)-5-cyclopropyl-2-fluoro-N,2-dimethylhex-4-en-3-imine
CID 166896627
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
(E)-5-fluoro-N-methyl-4-propan-2-ylhex-4-en-3-imine
CID 144510980
(E)-1-cyclopropyl-4-fluoro-N,3,4-trimethylpent-2-en-1-imine
CID 177146356
(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

Frequently Asked Questions

What is the IUPAC name of N,7-dimethyl-3-propan-2-ylnon-3-en-2-imine?
The IUPAC name of N,7-dimethyl-3-propan-2-ylnon-3-en-2-imine (CID 123671847) is N,7-dimethyl-3-propan-2-ylnon-3-en-2-imine.
What is the SMILES notation for N,7-dimethyl-3-propan-2-ylnon-3-en-2-imine?
The canonical SMILES for N,7-dimethyl-3-propan-2-ylnon-3-en-2-imine is CCC(C)CCC=C(/C(C)=N/C)C(C)C.
What is the InChIKey of N,7-dimethyl-3-propan-2-ylnon-3-en-2-imine?
The InChIKey is CFHWDRAGXPULQG-QENBWMSWSA-N. The full InChI is InChI=1S/C14H27N/c1-7-12(4)9-8-10-14(11(2)3)13(5)15-6/h10-12H,7-9H2,1-6H3/b14-10?,15-13+.
What are the key properties of N,7-dimethyl-3-propan-2-ylnon-3-en-2-imine?
N,7-dimethyl-3-propan-2-ylnon-3-en-2-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,7-dimethyl-3-propan-2-ylnon-3-en-2-imine is sourced from PubChem (CID 123671847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).