6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine

C18H22FN3O2 — CID 110112505

IUPAC6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
SMILESCNc1cccc(C2CN(Cc3cccc(OC)c3F)CCO2)n1
InChIInChI=1S/C18H22FN3O2/c1-20-17-8-4-6-14(21-17)16-12-22(9-10-24-16)11-13-5-3-7-15(23-2)18(13)19/h3-8,16H,9-12H2,1-2H3,(H,20,21)
InChIKeyYIGLBMWICCWMHV-UHFFFAOYSA-N
MW331.39 g/mol
LogP2.84
Rot. Bonds5

About 6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine

6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine (PubChem CID 110112505) has the molecular formula C18H22FN3O2 and a molecular weight of 331.39 g/mol. Its IUPAC name is 6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
PubChem CID110112505
Molecular FormulaC18H22FN3O2
Molecular Weight331.39 g/mol
Exact Mass331.17
IUPAC Name6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
SMILESCNc1cccc(C2CN(Cc3cccc(OC)c3F)CCO2)n1
InChIInChI=1S/C18H22FN3O2/c1-20-17-8-4-6-14(21-17)16-12-22(9-10-24-16)11-13-5-3-7-15(23-2)18(13)19/h3-8,16H,9-12H2,1-2H3,(H,20,21)
InChIKeyYIGLBMWICCWMHV-UHFFFAOYSA-N
XLogP2.84
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.39
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
CID 110112420
N-methyl-6-[(2R)-4-[(6-methyl-2-pyridinyl)methyl]morpholin-2-yl]pyridin-2-amine
CID 124972365
6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
CID 124944325
2-isoquinolin-3-yl-4-[(2-methoxyphenyl)methyl]morpholine
CID 110218627
4-[(2,3-dimethoxyphenyl)methyl]-2-(6-fluoroisoquinolin-3-yl)morpholine
CID 110218665
(2R)-4-[(2,3-dimethoxyphenyl)methyl]-2-(6-fluoroisoquinolin-3-yl)morpholine
CID 92600896
N-methyl-6-[(2R)-4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyridin-2-amine
CID 124957898
6-[4-[(2,6-dimethoxyphenyl)methyl]morpholin-2-yl]-N-pyrimidin-2-ylpyrazin-2-amine
CID 127251771
N-methyl-6-[(2R)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholin-2-yl]pyridin-2-amine
CID 125027230
N-(1,5-dimethylpyrazol-3-yl)-6-[(2R)-4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-2-amine
CID 125005462
(2S)-4-[(2-fluoro-6-methoxyphenyl)methyl]-2-pyrazin-2-ylmorpholine
CID 124972882
N-[6-[(2S)-4-[(2-methoxy-4-methylphenyl)methyl]morpholin-2-yl]-2-pyridinyl]-5-methyl-1,3,4-thiadiazol-2-amine
CID 124977478

Frequently Asked Questions

What is the IUPAC name of 6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
The IUPAC name of 6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine (CID 110112505) is 6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine is CNc1cccc(C2CN(Cc3cccc(OC)c3F)CCO2)n1.
What is the InChIKey of 6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
The InChIKey is YIGLBMWICCWMHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22FN3O2/c1-20-17-8-4-6-14(21-17)16-12-22(9-10-24-16)11-13-5-3-7-15(23-2)18(13)19/h3-8,16H,9-12H2,1-2H3,(H,20,21).
What are the key properties of 6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine has a molecular weight of 331.39 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine is sourced from PubChem (CID 110112505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).