(6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine

C13H17F2N — CID 169166356

IUPAC(6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine
SMILESCCC/C=C\C=C1\C=CC=C(C(F)F)N1C
InChIInChI=1S/C13H17F2N/c1-3-4-5-6-8-11-9-7-10-12(13(14)15)16(11)2/h5-10,13H,3-4H2,1-2H3/b6-5-,11-8-
InChIKeyRQCCSPWCDVXDLH-VRULOHATSA-N
MW225.28 g/mol
LogP3.88
Rot. Bonds4

About (6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine

(6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine (PubChem CID 169166356) has the molecular formula C13H17F2N and a molecular weight of 225.28 g/mol. Its IUPAC name is (6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine.

Molecular Properties

Compound Name(6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine
PubChem CID169166356
Molecular FormulaC13H17F2N
Molecular Weight225.28 g/mol
Exact Mass225.13
IUPAC Name(6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine
SMILESCCC/C=C\C=C1\C=CC=C(C(F)F)N1C
InChIInChI=1S/C13H17F2N/c1-3-4-5-6-8-11-9-7-10-12(13(14)15)16(11)2/h5-10,13H,3-4H2,1-2H3/b6-5-,11-8-
InChIKeyRQCCSPWCDVXDLH-VRULOHATSA-N
XLogP3.88
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.28
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 57534395
magnesium;N,N-dimethyl-4-(trifluoromethyl)benzene-5-id-1-amine;bromide
CID 57534410
1-fluoro-N-methyl-N-(1,1,2,2,2-pentafluoroethyl)cyclohexa-2,4-dien-1-amine
CID 88041910
(3E)-7,7,7-trifluoro-N,N,6-trimethylhepta-1,3-dien-3-amine
CID 88578859
(3Z,5E,8Z)-5-fluoro-1,8-dimethyl-2-methylidene-1-azacycloundeca-3,5,8-triene
CID 89299112
2-ethyl-1,6-dimethyl-4-(trifluoromethyl)-2H-pyridine
CID 123161901
N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine
CID 123265710
1-Ethyl-2-methylidene-5-(trifluoromethyl)pyridine
CID 123548735
6-(4-fluoropent-2-enylidene)-N,N-dimethylcyclohexa-1,3-dien-1-amine
CID 123629047
1,6-dimethyl-4-(trifluoromethyl)-2H-pyridine
CID 123633847
6-Ethyl-10-methyl-3-(trifluoromethyl)-8,9-dihydropyrido[1,2-a]azepine
CID 123877213
5-fluoro-N,4,4-trimethyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine
CID 126590863

Frequently Asked Questions

What is the IUPAC name of (6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine?
The IUPAC name of (6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine (CID 169166356) is (6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine.
What is the SMILES notation for (6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine?
The canonical SMILES for (6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine is CCC/C=C\C=C1\C=CC=C(C(F)F)N1C.
What is the InChIKey of (6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine?
The InChIKey is RQCCSPWCDVXDLH-VRULOHATSA-N. The full InChI is InChI=1S/C13H17F2N/c1-3-4-5-6-8-11-9-7-10-12(13(14)15)16(11)2/h5-10,13H,3-4H2,1-2H3/b6-5-,11-8-.
What are the key properties of (6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine?
(6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine has a molecular weight of 225.28 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 (6Z)-2-(difluoromethyl)-6-[(Z)-hex-2-enylidene]-1-methylpyridine is sourced from PubChem (CID 169166356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).