[5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid

C11H14FN3O3 — CID 154942859

IUPAC[5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid
SMILESCC1CN(c2nc(NC(=O)O)ccc2F)CCO1
InChIInChI=1S/C11H14FN3O3/c1-7-6-15(4-5-18-7)10-8(12)2-3-9(13-10)14-11(16)17/h2-3,7H,4-6H2,1H3,(H,13,14)(H,16,17)
InChIKeyXSKLAJGBUIZYML-UHFFFAOYSA-N
MW255.25 g/mol
LogP1.54
Rot. Bonds2

About [5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid

[5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid (PubChem CID 154942859) has the molecular formula C11H14FN3O3 and a molecular weight of 255.25 g/mol. Its IUPAC name is [5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid.

Molecular Properties

Compound Name[5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid
PubChem CID154942859
Molecular FormulaC11H14FN3O3
Molecular Weight255.25 g/mol
Exact Mass255.10
IUPAC Name[5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid
SMILESCC1CN(c2nc(NC(=O)O)ccc2F)CCO1
InChIInChI=1S/C11H14FN3O3/c1-7-6-15(4-5-18-7)10-8(12)2-3-9(13-10)14-11(16)17/h2-3,7H,4-6H2,1H3,(H,13,14)(H,16,17)
InChIKeyXSKLAJGBUIZYML-UHFFFAOYSA-N
XLogP1.54
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.25
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid?
The IUPAC name of [5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid (CID 154942859) is [5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid.
What is the SMILES notation for [5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid?
The canonical SMILES for [5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid is CC1CN(c2nc(NC(=O)O)ccc2F)CCO1.
What is the InChIKey of [5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid?
The InChIKey is XSKLAJGBUIZYML-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN3O3/c1-7-6-15(4-5-18-7)10-8(12)2-3-9(13-10)14-11(16)17/h2-3,7H,4-6H2,1H3,(H,13,14)(H,16,17).
What are the key properties of [5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid?
[5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid has a molecular weight of 255.25 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-6-(2-methylmorpholin-4-yl)-2-pyridinyl]carbamic acid is sourced from PubChem (CID 154942859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).