(Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine

C10H15F2N — CID 143345041

IUPAC(Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine
SMILESC/C=C\N=C(\C=C/C)C(C)(F)CF
InChIInChI=1S/C10H15F2N/c1-4-6-9(13-7-5-2)10(3,12)8-11/h4-7H,8H2,1-3H3/b6-4-,7-5-,13-9-
InChIKeyZJQHRCOMSNSRCZ-KDLBGYKSSA-N
MW187.23 g/mol
LogP3.23
Rot. Bonds4

About (Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine

(Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine (PubChem CID 143345041) has the molecular formula C10H15F2N and a molecular weight of 187.23 g/mol. Its IUPAC name is (Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine.

Molecular Properties

Compound Name(Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine
PubChem CID143345041
Molecular FormulaC10H15F2N
Molecular Weight187.23 g/mol
Exact Mass187.12
IUPAC Name(Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine
SMILESC/C=C\N=C(\C=C/C)C(C)(F)CF
InChIInChI=1S/C10H15F2N/c1-4-6-9(13-7-5-2)10(3,12)8-11/h4-7H,8H2,1-3H3/b6-4-,7-5-,13-9-
InChIKeyZJQHRCOMSNSRCZ-KDLBGYKSSA-N
XLogP3.23
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.23
LogP ≤ 53.23
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
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
(Z)-2-fluoro-N,2-dimethylhex-4-en-3-imine
CID 143810300
6-[(E)-1-fluoroprop-1-enyl]-5,7-dimethyl-4H-azepine
CID 144030424
ethane;(Z)-7,7,7-trifluoro-N-[(Z)-prop-1-enyl]hept-2-en-4-imine
CID 144801043
ethane;(Z)-1,1,1-trifluoro-N-[(Z)-prop-1-enyl]pent-3-en-2-imine
CID 145149525
6-methyl-7-(trifluoromethyl)-4H-azepine
CID 147512449
(1E)-N-ethenyl-1-(4-fluorocyclohexa-2,4-dien-1-ylidene)propan-2-imine
CID 155181207
(E)-N-ethenyl-6-fluoro-2,5-dimethylhex-4-en-3-imine
CID 155204692
(Z)-N-ethenyl-1,1,1-trifluoropent-3-en-2-imine
CID 155236673

Frequently Asked Questions

What is the IUPAC name of (Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine?
The IUPAC name of (Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine (CID 143345041) is (Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine.
What is the SMILES notation for (Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine?
The canonical SMILES for (Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine is C/C=C\N=C(\C=C/C)C(C)(F)CF.
What is the InChIKey of (Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine?
The InChIKey is ZJQHRCOMSNSRCZ-KDLBGYKSSA-N. The full InChI is InChI=1S/C10H15F2N/c1-4-6-9(13-7-5-2)10(3,12)8-11/h4-7H,8H2,1-3H3/b6-4-,7-5-,13-9-.
What are the key properties of (Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine?
(Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine has a molecular weight of 187.23 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,2-difluoro-2-methyl-N-[(Z)-prop-1-enyl]hex-4-en-3-imine is sourced from PubChem (CID 143345041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).