1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol

C14H20F2N2O2 — CID 63032651

IUPAC1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol
SMILESOC(CNCc1cc(F)ccc1F)CN1CCOCC1
InChIInChI=1S/C14H20F2N2O2/c15-12-1-2-14(16)11(7-12)8-17-9-13(19)10-18-3-5-20-6-4-18/h1-2,7,13,17,19H,3-6,8-10H2
InChIKeyRFLFLVBYSRORNC-UHFFFAOYSA-N
MW286.32 g/mol
LogP0.75
Rot. Bonds6

About 1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol

1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol (PubChem CID 63032651) has the molecular formula C14H20F2N2O2 and a molecular weight of 286.32 g/mol. Its IUPAC name is 1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol
PubChem CID63032651
Molecular FormulaC14H20F2N2O2
Molecular Weight286.32 g/mol
Exact Mass286.15
IUPAC Name1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol
SMILESOC(CNCc1cc(F)ccc1F)CN1CCOCC1
InChIInChI=1S/C14H20F2N2O2/c15-12-1-2-14(16)11(7-12)8-17-9-13(19)10-18-3-5-20-6-4-18/h1-2,7,13,17,19H,3-6,8-10H2
InChIKeyRFLFLVBYSRORNC-UHFFFAOYSA-N
XLogP0.75
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.32
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2,5-difluorophenyl)methyl]-2-morpholin-4-ylethanamine
CID 43312645
1-(4-fluoroanilino)-3-morpholin-4-ylpropan-2-ol
CID 60896474
1-[2-(3-fluorophenyl)ethylamino]-3-morpholin-4-ylpropan-2-ol
CID 60910058
1-[4-(2,5-difluorophenyl)piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 111824467
4-[[(2-hydroxy-3-morpholin-4-ylpropyl)amino]methyl]phenol
CID 115572172
1-[(2,5-difluorophenyl)methylamino]-4,4-dimethylpentan-2-ol
CID 103675866
1-morpholin-4-yl-3-(2,3,4-trifluoroanilino)propan-2-ol
CID 60896358
(2R)-1-[[5-(2-fluorophenyl)furan-2-yl]methylamino]-3-morpholin-4-ylpropan-2-ol
CID 8024988
1-[(2-morpholin-4-ylphenyl)methylamino]-3-pyrrolidin-1-ylpropan-2-ol
CID 110928639
1-(3,4-dihydro-1H-isochromen-5-ylmethylamino)-3-morpholin-4-ylpropan-2-ol
CID 167917444
(2S)-1-[(7-fluoroquinolin-2-yl)amino]-3-morpholin-4-ylpropan-2-ol
CID 97236554
(2S)-1-[2-[[(5-fluoro-2-methylphenyl)methylamino]methyl]-6-methoxyphenoxy]-3-morpholin-4-ylpropan-2-ol
CID 29001533

Frequently Asked Questions

What is the IUPAC name of 1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of 1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol (CID 63032651) is 1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for 1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for 1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol is OC(CNCc1cc(F)ccc1F)CN1CCOCC1.
What is the InChIKey of 1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol?
The InChIKey is RFLFLVBYSRORNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F2N2O2/c15-12-1-2-14(16)11(7-12)8-17-9-13(19)10-18-3-5-20-6-4-18/h1-2,7,13,17,19H,3-6,8-10H2.
What are the key properties of 1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol?
1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol has a molecular weight of 286.32 g/mol, XLogP of 0.75, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,5-difluorophenyl)methylamino]-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 63032651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).