1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol

C12H24N2O2S — CID 107295723

IUPAC1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol
SMILESOC(CNCC1CCSC1)CN1CCOCC1
InChIInChI=1S/C12H24N2O2S/c15-12(9-14-2-4-16-5-3-14)8-13-7-11-1-6-17-10-11/h11-13,15H,1-10H2
InChIKeyGBJBJUZKGWYGPF-UHFFFAOYSA-N
MW260.40 g/mol
LogP0.02
Rot. Bonds6

About 1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol

1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol (PubChem CID 107295723) has the molecular formula C12H24N2O2S and a molecular weight of 260.40 g/mol. Its IUPAC name is 1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol.

Molecular Properties

Compound Name1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol
PubChem CID107295723
Molecular FormulaC12H24N2O2S
Molecular Weight260.40 g/mol
Exact Mass260.16
IUPAC Name1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol
SMILESOC(CNCC1CCSC1)CN1CCOCC1
InChIInChI=1S/C12H24N2O2S/c15-12(9-14-2-4-16-5-3-14)8-13-7-11-1-6-17-10-11/h11-13,15H,1-10H2
InChIKeyGBJBJUZKGWYGPF-UHFFFAOYSA-N
XLogP0.02
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.40
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-morpholin-4-yl-3-(thian-2-ylmethylamino)propan-2-ol
CID 80600493
N-(thiolan-3-ylmethyl)morpholin-4-amine
CID 107132352
1-(3-methylbutylamino)-3-morpholin-4-ylpropan-2-ol
CID 60665903
(2S)-1-(methylamino)-3-morpholin-4-ylpropan-2-ol
CID 7201085
1-ethoxy-3-(thiolan-3-ylmethylamino)propan-2-ol
CID 107166431
1-(diethylamino)-3-(thiolan-3-ylmethylamino)propan-2-ol
CID 107295767
1-(2-chloroprop-2-enylamino)-3-morpholin-4-ylpropan-2-ol
CID 115574804
1-(2-methylprop-2-enylamino)-3-morpholin-4-ylpropan-2-ol
CID 115574800
1-[2-[di(propan-2-yl)amino]ethylamino]-3-morpholin-4-ylpropan-2-ol
CID 60665958
1-morpholin-4-yl-3-(3-propoxypropylamino)propan-2-ol
CID 82943258
1-morpholin-4-yl-3-(morpholin-4-ylamino)propan-2-ol
CID 83022230
1-(3-methylbut-2-enylamino)-3-morpholin-4-ylpropan-2-ol
CID 103605552

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol?
The IUPAC name of 1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol (CID 107295723) is 1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol.
What is the SMILES notation for 1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol?
The canonical SMILES for 1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol is OC(CNCC1CCSC1)CN1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol?
The InChIKey is GBJBJUZKGWYGPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2S/c15-12(9-14-2-4-16-5-3-14)8-13-7-11-1-6-17-10-11/h11-13,15H,1-10H2.
What are the key properties of 1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol?
1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol has a molecular weight of 260.40 g/mol, XLogP of 0.02, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-3-(thiolan-3-ylmethylamino)propan-2-ol is sourced from PubChem (CID 107295723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).