(E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine

C8H14FN — CID 163527626

IUPAC(E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine
SMILESC/N=C/C(F)=C(/C)C(C)C
InChIInChI=1S/C8H14FN/c1-6(2)7(3)8(9)5-10-4/h5-6H,1-4H3/b8-7+,10-5+
InChIKeyDQCRXIGPXRJCEA-LZIZUESTSA-N
MW143.20 g/mol
LogP2.59
Rot. Bonds2

About (E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine

(E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine (PubChem CID 163527626) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is (E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine.

Molecular Properties

Compound Name(E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine
PubChem CID163527626
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Name(E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine
SMILESC/N=C/C(F)=C(/C)C(C)C
InChIInChI=1S/C8H14FN/c1-6(2)7(3)8(9)5-10-4/h5-6H,1-4H3/b8-7+,10-5+
InChIKeyDQCRXIGPXRJCEA-LZIZUESTSA-N
XLogP2.59
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 52.59
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

(3Z,5E)-4-fluoro-2,3-dimethyl-6-propan-2-ylnona-3,5-diene
CID 167100921
(E)-2-fluoro-N-methylbut-2-en-1-imine
CID 91188405
methane;(Z)-2,3,4,5-tetramethylhex-3-ene;(E)-2,3,4,5-tetramethylhex-3-ene
CID 161097810
ethane;ethene;(Z)-N-methyl-2-propan-2-ylbut-2-en-1-imine
CID 169242531
1-N,3-dimethylbutane-1,2-diimine
CID 123957798
(Z)-N,3-dimethyl-2-(methyliminomethyl)but-1-en-1-amine
CID 142329757
2,3,4-trimethylpent-2-ene
CID 11270
N,2,3-trimethylbut-2-en-1-imine
CID 123452663
2,3,4,5,6,7,8,9,10,11-decamethyldodeca-3,6,9-triene
CID 123882095
acetic acid;2-methyliminoacetic acid
CID 87702194
(E)-3-methyl-4-methyliminobut-2-en-2-amine
CID 167081339
(3Z,5Z)-3,4-dichloro-5-fluoro-6,7-dimethylocta-1,3,5-triene
CID 155708974

Frequently Asked Questions

What is the IUPAC name of (E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine?
The IUPAC name of (E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine (CID 163527626) is (E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine.
What is the SMILES notation for (E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine?
The canonical SMILES for (E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine is C/N=C/C(F)=C(/C)C(C)C.
What is the InChIKey of (E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine?
The InChIKey is DQCRXIGPXRJCEA-LZIZUESTSA-N. The full InChI is InChI=1S/C8H14FN/c1-6(2)7(3)8(9)5-10-4/h5-6H,1-4H3/b8-7+,10-5+.
What are the key properties of (E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine?
(E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine has a molecular weight of 143.20 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine is sourced from PubChem (CID 163527626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).