3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine

C10H14F2N2 — CID 161207927

IUPAC3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine
SMILESC=C1C(C(F)F)=CC(C)=CN1N(C)C
InChIInChI=1S/C10H14F2N2/c1-7-5-9(10(11)12)8(2)14(6-7)13(3)4/h5-6,10H,2H2,1,3-4H3
InChIKeyCEUVSYVLLQZCFT-UHFFFAOYSA-N
MW200.23 g/mol
LogP2.39
Rot. Bonds2

About 3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine

3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine (PubChem CID 161207927) has the molecular formula C10H14F2N2 and a molecular weight of 200.23 g/mol. Its IUPAC name is 3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine.

Molecular Properties

Compound Name3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine
PubChem CID161207927
Molecular FormulaC10H14F2N2
Molecular Weight200.23 g/mol
Exact Mass200.11
IUPAC Name3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine
SMILESC=C1C(C(F)F)=CC(C)=CN1N(C)C
InChIInChI=1S/C10H14F2N2/c1-7-5-9(10(11)12)8(2)14(6-7)13(3)4/h5-6,10H,2H2,1,3-4H3
InChIKeyCEUVSYVLLQZCFT-UHFFFAOYSA-N
XLogP2.39
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.23
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine?
The IUPAC name of 3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine (CID 161207927) is 3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine.
What is the SMILES notation for 3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine?
The canonical SMILES for 3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine is C=C1C(C(F)F)=CC(C)=CN1N(C)C.
What is the InChIKey of 3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine?
The InChIKey is CEUVSYVLLQZCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N2/c1-7-5-9(10(11)12)8(2)14(6-7)13(3)4/h5-6,10H,2H2,1,3-4H3.
What are the key properties of 3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine?
3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine has a molecular weight of 200.23 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-N,N,5-trimethyl-2-methylidenepyridin-1-amine is sourced from PubChem (CID 161207927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).