5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine

C16H18FN3O2 — CID 125478362

IUPAC5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine
SMILESCOc1ncc(-c2cc(N)cnc2C)cc1C1(CF)COC1
InChIInChI=1S/C16H18FN3O2/c1-10-13(4-12(18)6-19-10)11-3-14(15(21-2)20-5-11)16(7-17)8-22-9-16/h3-6H,7-9,18H2,1-2H3
InChIKeyOVIWYGSDSDEJML-UHFFFAOYSA-N
MW303.34 g/mol
LogP2.28
Rot. Bonds4

About 5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine

5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine (PubChem CID 125478362) has the molecular formula C16H18FN3O2 and a molecular weight of 303.34 g/mol. Its IUPAC name is 5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine.

Molecular Properties

Compound Name5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine
PubChem CID125478362
Molecular FormulaC16H18FN3O2
Molecular Weight303.34 g/mol
Exact Mass303.14
IUPAC Name5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine
SMILESCOc1ncc(-c2cc(N)cnc2C)cc1C1(CF)COC1
InChIInChI=1S/C16H18FN3O2/c1-10-13(4-12(18)6-19-10)11-3-14(15(21-2)20-5-11)16(7-17)8-22-9-16/h3-6H,7-9,18H2,1-2H3
InChIKeyOVIWYGSDSDEJML-UHFFFAOYSA-N
XLogP2.28
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.34
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine with MolForge

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Related Compounds

2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[3-(fluoromethyl)oxetan-3-yl]-2-pyridinyl]oxy]ethanol
CID 134609520
5-(5-amino-2-methyl-3-pyridinyl)pyrimidin-2-amine
CID 71070877
5-(4-fluorophenyl)-6-methoxypyridin-3-amine
CID 46311843
N-[5-[5-(3-fluorooxetan-3-yl)-6-methoxy-3-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 134609346
5-bromo-3-[3-(difluoromethyl)oxetan-3-yl]-2-methoxypyridine
CID 118949148
5-(2,6-dimorpholin-4-yl-4-pyridinyl)-6-methylpyridin-3-amine
CID 168929038
5-(4-chlorophenyl)-6-methylpyridin-3-amine
CID 165369043
5-[6-(2,2-difluoroethoxy)-5-morpholin-4-ylpyridazin-3-yl]-6-methylpyridin-3-amine
CID 90464912
6-methoxy-5-[4-(trifluoromethoxy)phenyl]pyridin-3-amine
CID 133086741
2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-(2-methoxy-4-pyridinyl)-2-pyridinyl]oxy]ethanol
CID 168928761
5-[(4R)-2-hydroxyoxaborolan-4-yl]-3-(6-methoxy-5-propoxy-3-pyridinyl)-2-methylpyridine
CID 156900461
6-methoxy-5-(2-methylpyrazol-3-yl)pyridin-3-amine
CID 69132531

Frequently Asked Questions

What is the IUPAC name of 5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine?
The IUPAC name of 5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine (CID 125478362) is 5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine.
What is the SMILES notation for 5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine?
The canonical SMILES for 5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine is COc1ncc(-c2cc(N)cnc2C)cc1C1(CF)COC1.
What is the InChIKey of 5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine?
The InChIKey is OVIWYGSDSDEJML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O2/c1-10-13(4-12(18)6-19-10)11-3-14(15(21-2)20-5-11)16(7-17)8-22-9-16/h3-6H,7-9,18H2,1-2H3.
What are the key properties of 5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine?
5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine has a molecular weight of 303.34 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-[3-(fluoromethyl)oxetan-3-yl]-6-methoxy-3-pyridinyl]-6-methylpyridin-3-amine is sourced from PubChem (CID 125478362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).