2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one

C12H16FN3O2 — CID 112551724

IUPAC2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
SMILESCC(Nc1ncccc1F)C(=O)N1CCOCC1
InChIInChI=1S/C12H16FN3O2/c1-9(12(17)16-5-7-18-8-6-16)15-11-10(13)3-2-4-14-11/h2-4,9H,5-8H2,1H3,(H,14,15)
InChIKeyRNWZMONKEPUMCC-UHFFFAOYSA-N
MW253.28 g/mol
LogP0.88
Rot. Bonds3

About 2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one

2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one (PubChem CID 112551724) has the molecular formula C12H16FN3O2 and a molecular weight of 253.28 g/mol. Its IUPAC name is 2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
PubChem CID112551724
Molecular FormulaC12H16FN3O2
Molecular Weight253.28 g/mol
Exact Mass253.12
IUPAC Name2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
SMILESCC(Nc1ncccc1F)C(=O)N1CCOCC1
InChIInChI=1S/C12H16FN3O2/c1-9(12(17)16-5-7-18-8-6-16)15-11-10(13)3-2-4-14-11/h2-4,9H,5-8H2,1H3,(H,14,15)
InChIKeyRNWZMONKEPUMCC-UHFFFAOYSA-N
XLogP0.88
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one with MolForge

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Related Compounds

2-[(3-fluoro-2-pyridinyl)amino]-1-piperidin-1-ylpropan-1-one
CID 112551708
2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
CID 113408683
3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 62733426
2-fluoro-6-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]benzonitrile
CID 43580691
2-(2,5-difluoroanilino)-1-morpholin-4-ylpropan-1-one
CID 43083934
2-(5-chloro-2-fluoroanilino)-1-morpholin-4-ylpropan-1-one
CID 43385605
2-[1-(2,6-difluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one
CID 115588993
2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide
CID 62733234
2,3-difluoro-N-(1-morpholin-4-yl-1-oxopropan-2-yl)benzamide
CID 115605200
1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one
CID 81402403
3-bromo-N-(1-morpholin-4-yl-1-oxopropan-2-yl)pyridine-2-carboxamide
CID 107519294
2-[(8-methylquinazolin-4-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 133388467

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one (CID 112551724) is 2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one is CC(Nc1ncccc1F)C(=O)N1CCOCC1.
What is the InChIKey of 2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one?
The InChIKey is RNWZMONKEPUMCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN3O2/c1-9(12(17)16-5-7-18-8-6-16)15-11-10(13)3-2-4-14-11/h2-4,9H,5-8H2,1H3,(H,14,15).
What are the key properties of 2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one?
2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one has a molecular weight of 253.28 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 112551724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).