(2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol

C14H26N4O2 — CID 98772196

IUPAC(2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol
SMILESC[C@H](NC[C@@H](O)CN1CCOCC1)[C@H](C)n1cccn1
InChIInChI=1S/C14H26N4O2/c1-12(13(2)18-5-3-4-16-18)15-10-14(19)11-17-6-8-20-9-7-17/h3-5,12-15,19H,6-11H2,1-2H3/t12-,13-,14+/m0/s1
InChIKeyOSTHRZGDJWBYHV-MELADBBJSA-N
MW282.39 g/mol
LogP0.12
Rot. Bonds7

About (2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol

(2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol (PubChem CID 98772196) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is (2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol
PubChem CID98772196
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name(2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol
SMILESC[C@H](NC[C@@H](O)CN1CCOCC1)[C@H](C)n1cccn1
InChIInChI=1S/C14H26N4O2/c1-12(13(2)18-5-3-4-16-18)15-10-14(19)11-17-6-8-20-9-7-17/h3-5,12-15,19H,6-11H2,1-2H3/t12-,13-,14+/m0/s1
InChIKeyOSTHRZGDJWBYHV-MELADBBJSA-N
XLogP0.12
TPSA62.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze (2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol with MolForge

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Related Compounds

(2S,3S)-N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-3-pyrazol-1-ylbutan-2-amine
CID 95277071
(2R)-N-[(2S)-1-morpholin-4-ylpropan-2-yl]-2-pyrazol-1-ylpropanamide
CID 95134476
N-(oxan-4-yl)-2-[[(2R,3S)-3-pyrazol-1-ylbutan-2-yl]amino]acetamide
CID 95326337
(2S)-1-(methylamino)-3-morpholin-4-ylpropan-2-ol
CID 7201085
1-morpholin-4-yl-3-(morpholin-4-ylamino)propan-2-ol
CID 83022230
4-[(2R)-2-hydroxy-3-[[(2S,3R)-3-pyrazol-1-ylbutan-2-yl]amino]propoxy]benzonitrile
CID 100844307
1-(4-methoxybutan-2-ylamino)-3-morpholin-4-ylpropan-2-ol
CID 64604856
1-[[(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-3-morpholin-4-ylpropan-2-ol
CID 166435620
1-[(6-methyl-2-pyridinyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 10966962
(1S)-1-(2-chlorophenyl)-2-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]ethanol
CID 124824047
1-(methoxyamino)-3-morpholin-4-ylpropan-2-ol
CID 60702622
1-(3-methylbutylamino)-3-morpholin-4-ylpropan-2-ol
CID 60665903

Frequently Asked Questions

What is the IUPAC name of (2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol?
The IUPAC name of (2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol (CID 98772196) is (2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol.
What is the SMILES notation for (2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol?
The canonical SMILES for (2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol is C[C@H](NC[C@@H](O)CN1CCOCC1)[C@H](C)n1cccn1.
What is the InChIKey of (2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol?
The InChIKey is OSTHRZGDJWBYHV-MELADBBJSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-12(13(2)18-5-3-4-16-18)15-10-14(19)11-17-6-8-20-9-7-17/h3-5,12-15,19H,6-11H2,1-2H3/t12-,13-,14+/m0/s1.
What are the key properties of (2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol?
(2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol has a molecular weight of 282.39 g/mol, XLogP of 0.12, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-morpholin-4-yl-3-[[(2S,3S)-3-pyrazol-1-ylbutan-2-yl]amino]propan-2-ol is sourced from PubChem (CID 98772196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).