N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine

C15H24FN3O — CID 105384909

IUPACN-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine
SMILESCC1COCCN1c1nccc(CNC(C)(C)C)c1F
InChIInChI=1S/C15H24FN3O/c1-11-10-20-8-7-19(11)14-13(16)12(5-6-17-14)9-18-15(2,3)4/h5-6,11,18H,7-10H2,1-4H3
InChIKeyXZOOIEAHWRCXRN-UHFFFAOYSA-N
MW281.37 g/mol
LogP2.33
Rot. Bonds3

About N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine

N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine (PubChem CID 105384909) has the molecular formula C15H24FN3O and a molecular weight of 281.37 g/mol. Its IUPAC name is N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine
PubChem CID105384909
Molecular FormulaC15H24FN3O
Molecular Weight281.37 g/mol
Exact Mass281.19
IUPAC NameN-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine
SMILESCC1COCCN1c1nccc(CNC(C)(C)C)c1F
InChIInChI=1S/C15H24FN3O/c1-11-10-20-8-7-19(11)14-13(16)12(5-6-17-14)9-18-15(2,3)4/h5-6,11,18H,7-10H2,1-4H3
InChIKeyXZOOIEAHWRCXRN-UHFFFAOYSA-N
XLogP2.33
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.37
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine (CID 105384909) is N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine is CC1COCCN1c1nccc(CNC(C)(C)C)c1F.
What is the InChIKey of N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine?
The InChIKey is XZOOIEAHWRCXRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FN3O/c1-11-10-20-8-7-19(11)14-13(16)12(5-6-17-14)9-18-15(2,3)4/h5-6,11,18H,7-10H2,1-4H3.
What are the key properties of N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine?
N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine has a molecular weight of 281.37 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-fluoro-2-(3-methylmorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 105384909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).