(2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol

C16H20FN3O2 — CID 97236554

IUPAC(2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol
SMILESO[C@@H](CNc1ccc2ccc(F)cc2n1)CN1CCOCC1
InChIInChI=1S/C16H20FN3O2/c17-13-3-1-12-2-4-16(19-15(12)9-13)18-10-14(21)11-20-5-7-22-8-6-20/h1-4,9,14,21H,5-8,10-11H2,(H,18,19)/t14-/m0/s1
InChIKeyWHTBOJXKZBGEIP-AWEZNQCLSA-N
MW305.35 g/mol
LogP1.48
Rot. Bonds5

About (2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol

(2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol (PubChem CID 97236554) has the molecular formula C16H20FN3O2 and a molecular weight of 305.35 g/mol. Its IUPAC name is (2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name(2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol
PubChem CID97236554
Molecular FormulaC16H20FN3O2
Molecular Weight305.35 g/mol
Exact Mass305.15
IUPAC Name(2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol
SMILESO[C@@H](CNc1ccc2ccc(F)cc2n1)CN1CCOCC1
InChIInChI=1S/C16H20FN3O2/c17-13-3-1-12-2-4-16(19-15(12)9-13)18-10-14(21)11-20-5-7-22-8-6-20/h1-4,9,14,21H,5-8,10-11H2,(H,18,19)/t14-/m0/s1
InChIKeyWHTBOJXKZBGEIP-AWEZNQCLSA-N
XLogP1.48
TPSA57.62 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.35
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol with MolForge

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Related Compounds

1-(4-fluoroanilino)-3-morpholin-4-ylpropan-2-ol
CID 60896474
1-[(6-methyl-2-pyridinyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 10966962
1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol
CID 63032651
1-morpholin-4-yl-3-(2,3,4-trifluoroanilino)propan-2-ol
CID 60896358
1-(2,6-dichloroanilino)-3-morpholin-4-ylpropan-2-ol
CID 65468625
1-[2-(3-fluorophenyl)ethylamino]-3-morpholin-4-ylpropan-2-ol
CID 60910058
2-(4-fluorophenyl)-N-(2-hydroxy-3-morpholin-4-ylpropyl)quinoline-4-carboxamide
CID 112799485
(2S)-1-(4-chloroanilino)-3-morpholin-4-ylpropan-2-ol
CID 92856830
1-[4-(2,5-difluorophenyl)piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 111824467
1-morpholin-4-yl-3-[[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]amino]propan-2-ol
CID 133383194
1-(2-chloroanilino)-3-morpholin-4-ylpropan-2-ol
CID 60898557
1-morpholin-4-yl-3-[2-(trifluoromethyl)anilino]propan-2-ol
CID 60898999

Frequently Asked Questions

What is the IUPAC name of (2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of (2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol (CID 97236554) is (2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for (2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for (2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol is O[C@@H](CNc1ccc2ccc(F)cc2n1)CN1CCOCC1.
What is the InChIKey of (2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol?
The InChIKey is WHTBOJXKZBGEIP-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H20FN3O2/c17-13-3-1-12-2-4-16(19-15(12)9-13)18-10-14(21)11-20-5-7-22-8-6-20/h1-4,9,14,21H,5-8,10-11H2,(H,18,19)/t14-/m0/s1.
What are the key properties of (2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol?
(2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol has a molecular weight of 305.35 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 97236554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).