(Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine

C10H14F3N — CID 144801044

IUPAC(Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine
SMILESC/C=C\N=C(/C=C\C)CCC(F)(F)F
InChIInChI=1S/C10H14F3N/c1-3-5-9(14-8-4-2)6-7-10(11,12)13/h3-5,8H,6-7H2,1-2H3/b5-3-,8-4-,14-9+
InChIKeyYINNEOZOUXCOSX-CKKHOXKSSA-N
MW205.22 g/mol
LogP3.88
Rot. Bonds4

About (Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine

(Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine (PubChem CID 144801044) has the molecular formula C10H14F3N and a molecular weight of 205.22 g/mol. Its IUPAC name is (Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine.

Molecular Properties

Compound Name(Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine
PubChem CID144801044
Molecular FormulaC10H14F3N
Molecular Weight205.22 g/mol
Exact Mass205.11
IUPAC Name(Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine
SMILESC/C=C\N=C(/C=C\C)CCC(F)(F)F
InChIInChI=1S/C10H14F3N/c1-3-5-9(14-8-4-2)6-7-10(11,12)13/h3-5,8H,6-7H2,1-2H3/b5-3-,8-4-,14-9+
InChIKeyYINNEOZOUXCOSX-CKKHOXKSSA-N
XLogP3.88
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 53.88
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

4-fluoro-N-[(Z)-prop-1-enyl]pent-2-enimidoyl fluoride
CID 134172148
(3Z)-N-ethenyl-1,1,1-trifluorohexa-3,5-dien-2-imine
CID 134532241
N-ethenyl-6,6,6-trifluorohex-1-en-3-imine
CID 134549610
(2Z,7Z)-3-methyl-9-(trifluoromethyl)-5,6-dihydro-4H-azonine
CID 135292598
(Z)-1,1,1-trifluoro-N-methylhept-3-en-2-imine
CID 142438419
3-methyl-7-(trifluoromethyl)-4H-azepine
CID 142851450
(E)-N-ethenyl-3-(trifluoromethyl)pent-3-en-2-imine
CID 142927437
ethane;5-methyl-2-(trifluoromethyl)-3H-azepine
CID 143347215
Ethane;2-(trifluoromethyl)-3,4-dihydropyridine
CID 144625238
ethane;(Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine
CID 144801043
ethane;6,6,6-trifluoro-N-[(Z)-prop-1-enyl]hex-1-en-3-imine
CID 144801050
ethane;1,1,1-trifluoro-N-[(Z)-prop-1-enyl]but-3-en-2-imine
CID 145149506

Frequently Asked Questions

What is the IUPAC name of (Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine?
The IUPAC name of (Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine (CID 144801044) is (Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine.
What is the SMILES notation for (Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine?
The canonical SMILES for (Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine is C/C=C\N=C(/C=C\C)CCC(F)(F)F.
What is the InChIKey of (Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine?
The InChIKey is YINNEOZOUXCOSX-CKKHOXKSSA-N. The full InChI is InChI=1S/C10H14F3N/c1-3-5-9(14-8-4-2)6-7-10(11,12)13/h3-5,8H,6-7H2,1-2H3/b5-3-,8-4-,14-9+.
What are the key properties of (Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine?
(Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine has a molecular weight of 205.22 g/mol, XLogP of 3.88, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine is sourced from PubChem (CID 144801044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).