4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine

C9H11F2N — CID 145359778

IUPAC4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine
SMILESC=C1C=C(C(F)F)C(C)=CN1C
InChIInChI=1S/C9H11F2N/c1-6-5-12(3)7(2)4-8(6)9(10)11/h4-5,9H,2H2,1,3H3
InChIKeyWCPZQTYUBIXLHH-UHFFFAOYSA-N
MW171.19 g/mol
LogP2.54
Rot. Bonds1

About 4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine

4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine (PubChem CID 145359778) has the molecular formula C9H11F2N and a molecular weight of 171.19 g/mol. Its IUPAC name is 4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine.

Molecular Properties

Compound Name4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine
PubChem CID145359778
Molecular FormulaC9H11F2N
Molecular Weight171.19 g/mol
Exact Mass171.09
IUPAC Name4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine
SMILESC=C1C=C(C(F)F)C(C)=CN1C
InChIInChI=1S/C9H11F2N/c1-6-5-12(3)7(2)4-8(6)9(10)11/h4-5,9H,2H2,1,3H3
InChIKeyWCPZQTYUBIXLHH-UHFFFAOYSA-N
XLogP2.54
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.19
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

lithium N,N-dimethyl-4-(trifluoromethyl)benzene-5-id-1-amine
CID 57534395
magnesium;N,N-dimethyl-4-(trifluoromethyl)benzene-5-id-1-amine;bromide
CID 57534410
2-Methylidene-1-(2-methylpropyl)-5-(trifluoromethyl)pyridine
CID 67473380
1-(fluoromethyl)-2H-quinolizine
CID 67907299
9-(trifluoromethyl)-4H-quinolizine
CID 88314887
1-(fluoromethyl)-4H-quinolizine
CID 88500989
1-Ethyl-2,4-bis(trifluoromethyl)-1-azacyclohepta-2,4,5-triene
CID 90084212
1-(Difluoromethyl)-2-methylidene-5-propan-2-ylpyridine
CID 117878111
5-Tert-butyl-1-(difluoromethyl)-2-methylidenepyridine
CID 117878183
2-Iodo-10-(trifluoromethyl)-1-azabicyclo[5.4.0]undeca-2,5,6,8,10-pentaene
CID 118448163
2-Chloro-1,2-dimethyl-5-(trifluoromethyl)pyridine
CID 118478764
2-Chloro-1-ethyl-2-methyl-5-(trifluoromethyl)pyridine
CID 118478765

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine?
The IUPAC name of 4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine (CID 145359778) is 4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine.
What is the SMILES notation for 4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine?
The canonical SMILES for 4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine is C=C1C=C(C(F)F)C(C)=CN1C.
What is the InChIKey of 4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine?
The InChIKey is WCPZQTYUBIXLHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F2N/c1-6-5-12(3)7(2)4-8(6)9(10)11/h4-5,9H,2H2,1,3H3.
What are the key properties of 4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine?
4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine has a molecular weight of 171.19 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-1,5-dimethyl-2-methylidenepyridine is sourced from PubChem (CID 145359778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).