N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine

C16H19FN2O — CID 107170638

IUPACN-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine
SMILESCc1ccc(Oc2cccc(NC(C)(C)C)n2)cc1F
InChIInChI=1S/C16H19FN2O/c1-11-8-9-12(10-13(11)17)20-15-7-5-6-14(18-15)19-16(2,3)4/h5-10H,1-4H3,(H,18,19)
InChIKeyXRBBJBNZOOFBTJ-UHFFFAOYSA-N
MW274.34 g/mol
LogP4.53
Rot. Bonds3

About N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine

N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine (PubChem CID 107170638) has the molecular formula C16H19FN2O and a molecular weight of 274.34 g/mol. Its IUPAC name is N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine.

Molecular Properties

Compound NameN-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine
PubChem CID107170638
Molecular FormulaC16H19FN2O
Molecular Weight274.34 g/mol
Exact Mass274.15
IUPAC NameN-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine
SMILESCc1ccc(Oc2cccc(NC(C)(C)C)n2)cc1F
InChIInChI=1S/C16H19FN2O/c1-11-8-9-12(10-13(11)17)20-15-7-5-6-14(18-15)19-16(2,3)4/h5-10H,1-4H3,(H,18,19)
InChIKeyXRBBJBNZOOFBTJ-UHFFFAOYSA-N
XLogP4.53
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-bromo-3-methylphenoxy)-N-tert-butylpyridin-2-amine
CID 83134194
N-tert-butyl-6-(4-ethoxyphenoxy)pyridin-2-amine
CID 115498695
2-tert-butyl-4-chloro-6-(3-fluoro-4-methylphenoxy)pyrimidine
CID 107169197
6-(2-bromo-4-methoxyphenoxy)-N-tert-butylpyridin-2-amine
CID 104708310
N-tert-butyl-6-(2-chloro-4-fluorophenoxy)pyridin-2-amine
CID 115498675
[2-tert-butyl-6-(3-fluoro-4-methylphenoxy)-4-pyridinyl]methanamine
CID 107170699
6-(3-fluoro-4-methylphenoxy)-2-N-methylpyridine-2,3-diamine
CID 68661487
N-tert-butyl-6-(2-chloro-4-methylphenoxy)pyridin-2-amine
CID 115498798
6-(3-fluoro-4-methylphenoxy)-2-methylsulfanyl-N-propylpyrimidin-4-amine
CID 107171734
6-(3-methylphenoxy)-N-propylpyridin-2-amine
CID 80869779
N-tert-butyl-6-(2,2,2-trifluoroethoxy)pyridin-2-amine
CID 115498610
6-butoxy-N-tert-butylpyridin-2-amine
CID 115498673

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine?
The IUPAC name of N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine (CID 107170638) is N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine.
What is the SMILES notation for N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine?
The canonical SMILES for N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine is Cc1ccc(Oc2cccc(NC(C)(C)C)n2)cc1F.
What is the InChIKey of N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine?
The InChIKey is XRBBJBNZOOFBTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2O/c1-11-8-9-12(10-13(11)17)20-15-7-5-6-14(18-15)19-16(2,3)4/h5-10H,1-4H3,(H,18,19).
What are the key properties of N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine?
N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine has a molecular weight of 274.34 g/mol, XLogP of 4.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-6-(3-fluoro-4-methylphenoxy)pyridin-2-amine is sourced from PubChem (CID 107170638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).