(2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol

C9H19NO3 — CID 106932860

IUPAC(2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol
SMILESCC1COC(CO)CN1C[C@@H](C)O
InChIInChI=1S/C9H19NO3/c1-7-6-13-9(5-11)4-10(7)3-8(2)12/h7-9,11-12H,3-6H2,1-2H3/t7?,8-,9?/m1/s1
InChIKeyYBWOUTMVIKKIMU-QJAFJHJLSA-N
MW189.25 g/mol
LogP-0.55
Rot. Bonds3

About (2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol

(2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol (PubChem CID 106932860) has the molecular formula C9H19NO3 and a molecular weight of 189.25 g/mol. Its IUPAC name is (2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol
PubChem CID106932860
Molecular FormulaC9H19NO3
Molecular Weight189.25 g/mol
Exact Mass189.14
IUPAC Name(2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol
SMILESCC1COC(CO)CN1C[C@@H](C)O
InChIInChI=1S/C9H19NO3/c1-7-6-13-9(5-11)4-10(7)3-8(2)12/h7-9,11-12H,3-6H2,1-2H3/t7?,8-,9?/m1/s1
InChIKeyYBWOUTMVIKKIMU-QJAFJHJLSA-N
XLogP-0.55
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.25
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]-2-methylpropanoate
CID 81204311
3-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-1-ol
CID 114286796
[5-methyl-4-(3-methylbut-2-enyl)morpholin-2-yl]methanol
CID 81218750
1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]butan-2-one
CID 81204330
(2R)-1-[(2S,5R)-4-[(2S)-2-hydroxypropyl]-2,5-dimethylpiperazin-1-yl]propan-2-ol
CID 124524922
1-(2-fluorophenyl)-3-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]-2-methylpropan-1-ol
CID 115997195
1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-one
CID 81204259
1-(4-aminopyrazol-1-yl)-3-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol
CID 81205949
[4-[2,2-dimethyl-3-(2-methylpropylamino)propyl]-5-methylmorpholin-2-yl]methanol
CID 81212705
[5-methyl-4-[(4-propan-2-ylmorpholin-2-yl)methyl]morpholin-2-yl]methanol
CID 114286891
3-[[2-(hydroxymethyl)-5-methylmorpholin-4-yl]methyl]pentan-3-ol
CID 114495754
[(2S,5R)-4,5-dimethylmorpholin-2-yl]methanol
CID 155290635

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol?
The IUPAC name of (2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol (CID 106932860) is (2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol.
What is the SMILES notation for (2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol?
The canonical SMILES for (2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol is CC1COC(CO)CN1C[C@@H](C)O.
What is the InChIKey of (2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol?
The InChIKey is YBWOUTMVIKKIMU-QJAFJHJLSA-N. The full InChI is InChI=1S/C9H19NO3/c1-7-6-13-9(5-11)4-10(7)3-8(2)12/h7-9,11-12H,3-6H2,1-2H3/t7?,8-,9?/m1/s1.
What are the key properties of (2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol?
(2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol has a molecular weight of 189.25 g/mol, XLogP of -0.55, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol is sourced from PubChem (CID 106932860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).