N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine

C16H20FN3 — CID 62293985

IUPACN-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine
SMILESCNCc1c(C)cc(C)nc1N(C)c1cccc(F)c1
InChIInChI=1S/C16H20FN3/c1-11-8-12(2)19-16(15(11)10-18-3)20(4)14-7-5-6-13(17)9-14/h5-9,18H,10H2,1-4H3
InChIKeyRYNJEUUQMUNPEW-UHFFFAOYSA-N
MW273.35 g/mol
LogP3.32
Rot. Bonds4

About N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine

N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine (PubChem CID 62293985) has the molecular formula C16H20FN3 and a molecular weight of 273.35 g/mol. Its IUPAC name is N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine
PubChem CID62293985
Molecular FormulaC16H20FN3
Molecular Weight273.35 g/mol
Exact Mass273.16
IUPAC NameN-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine
SMILESCNCc1c(C)cc(C)nc1N(C)c1cccc(F)c1
InChIInChI=1S/C16H20FN3/c1-11-8-12(2)19-16(15(11)10-18-3)20(4)14-7-5-6-13(17)9-14/h5-9,18H,10H2,1-4H3
InChIKeyRYNJEUUQMUNPEW-UHFFFAOYSA-N
XLogP3.32
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.35
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine?
The IUPAC name of N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine (CID 62293985) is N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine.
What is the SMILES notation for N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine?
The canonical SMILES for N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine is CNCc1c(C)cc(C)nc1N(C)c1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine?
The InChIKey is RYNJEUUQMUNPEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3/c1-11-8-12(2)19-16(15(11)10-18-3)20(4)14-7-5-6-13(17)9-14/h5-9,18H,10H2,1-4H3.
What are the key properties of N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine?
N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine has a molecular weight of 273.35 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-N,4,6-trimethyl-3-(methylaminomethyl)pyridin-2-amine is sourced from PubChem (CID 62293985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).