(Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine

C8H14FN — CID 129299980

IUPAC(Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine
SMILESC/C=C(/C)CC(F)/C=N/C
InChIInChI=1S/C8H14FN/c1-4-7(2)5-8(9)6-10-3/h4,6,8H,5H2,1-3H3/b7-4-,10-6+
InChIKeySSKSHNOOSHDQBV-HLWKLQMVSA-N
MW143.20 g/mol
LogP2.38
Rot. Bonds3

About (Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine

(Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine (PubChem CID 129299980) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is (Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine.

Molecular Properties

Compound Name(Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine
PubChem CID129299980
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Name(Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine
SMILESC/C=C(/C)CC(F)/C=N/C
InChIInChI=1S/C8H14FN/c1-4-7(2)5-8(9)6-10-3/h4,6,8H,5H2,1-3H3/b7-4-,10-6+
InChIKeySSKSHNOOSHDQBV-HLWKLQMVSA-N
XLogP2.38
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 52.38
H-Bond Donors ≤ 50
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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Related Compounds

Squalene N-methylimine
CID 6450082
4-(2-fluoroethyl)-3H-pyridin-1-ium
CID 57261287
3-Fluoro-5-methyl-2,3-dihydropyridine
CID 68083425
(E)-2-fluoro-5-methylhept-4-en-1-imine
CID 89953267
(Z)-2-fluoro-N,4-dimethylhex-4-en-3-imine
CID 123257135
2-fluoro-5-methyl-3,4-dihydro-2H-azepine
CID 123433072
(E)-3-methyl-N-(3,3,3-trifluoropropyl)pent-2-en-1-imine
CID 123586957
(3Z)-2,6-difluoro-N,4-dimethylhexa-3,5-dien-1-imine
CID 123726188
N-[(1Z,3E)-4-fluoro-2-propylhepta-1,3-dienyl]ethanimine
CID 129172083
(2E)-3-ethenyl-2-ethylidene-3-fluoro-N-methylpent-4-en-1-imine
CID 129196407
(E)-N-methyl-2-(trifluoromethyl)hex-2-en-1-imine
CID 142438396
2-(1-Fluoroethyl)-5-methyl-2,3-dihydropyridine
CID 143887758

Frequently Asked Questions

What is the IUPAC name of (Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine?
The IUPAC name of (Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine (CID 129299980) is (Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine.
What is the SMILES notation for (Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine?
The canonical SMILES for (Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine is C/C=C(/C)CC(F)/C=N/C.
What is the InChIKey of (Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine?
The InChIKey is SSKSHNOOSHDQBV-HLWKLQMVSA-N. The full InChI is InChI=1S/C8H14FN/c1-4-7(2)5-8(9)6-10-3/h4,6,8H,5H2,1-3H3/b7-4-,10-6+.
What are the key properties of (Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine?
(Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine has a molecular weight of 143.20 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-fluoro-N,4-dimethylhex-4-en-1-imine is sourced from PubChem (CID 129299980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).