(2S)-3-morpholin-4-ylpropane-1,2-diol

C7H15NO3 — CID 1268043

IUPAC(2S)-3-morpholin-4-ylpropane-1,2-diol
SMILESOC[C@@H](O)CN1CCOCC1
InChIInChI=1S/C7H15NO3/c9-6-7(10)5-8-1-3-11-4-2-8/h7,9-10H,1-6H2/t7-/m0/s1
InChIKeyVZBNUEHCOOXOHR-ZETCQYMHSA-N
MW161.20 g/mol
LogP-1.33
Rot. Bonds3

About (2S)-3-morpholin-4-ylpropane-1,2-diol

(2S)-3-morpholin-4-ylpropane-1,2-diol (PubChem CID 1268043) has the molecular formula C7H15NO3 and a molecular weight of 161.20 g/mol. Its IUPAC name is (2S)-3-morpholin-4-ylpropane-1,2-diol.

Molecular Properties

Compound Name(2S)-3-morpholin-4-ylpropane-1,2-diol
PubChem CID1268043
Molecular FormulaC7H15NO3
Molecular Weight161.20 g/mol
Exact Mass161.11
IUPAC Name(2S)-3-morpholin-4-ylpropane-1,2-diol
SMILESOC[C@@H](O)CN1CCOCC1
InChIInChI=1S/C7H15NO3/c9-6-7(10)5-8-1-3-11-4-2-8/h7,9-10H,1-6H2/t7-/m0/s1
InChIKeyVZBNUEHCOOXOHR-ZETCQYMHSA-N
XLogP-1.33
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 5-1.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2S)-3-morpholin-4-ylpropane-1,2-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-chloro-3-morpholin-4-ylpropan-2-ol
CID 10080987
1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-2-ol
CID 129310449
(2S)-3-piperidin-1-ylpropane-1,2-diol
CID 854495
(2S)-1-(methylamino)-3-morpholin-4-ylpropan-2-ol
CID 7201085
3-hydroxy-4-morpholin-4-ylbutanoic acid
CID 79006775
(2S)-1-(1,4-diazepan-1-yl)-3-morpholin-4-ylpropan-2-ol
CID 95067014
1-[4-(3,3-dimethylbutyl)piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 110899952
(3R)-3-hydroxy-4-morpholin-4-ylbutanamide
CID 69066222
1-morpholin-4-yl-3-(morpholin-4-ylamino)propan-2-ol
CID 83022230
3-[4-(2-hydroxypropyl)piperazin-1-yl]propane-1,2-diol
CID 139832285
1-morpholin-4-ylheptan-2-ol
CID 15312312
(2R)-1-[4-[(2R)-2-hydroxy-2-phenylethyl]piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 95322241

Frequently Asked Questions

What is the IUPAC name of (2S)-3-morpholin-4-ylpropane-1,2-diol?
The IUPAC name of (2S)-3-morpholin-4-ylpropane-1,2-diol (CID 1268043) is (2S)-3-morpholin-4-ylpropane-1,2-diol.
What is the SMILES notation for (2S)-3-morpholin-4-ylpropane-1,2-diol?
The canonical SMILES for (2S)-3-morpholin-4-ylpropane-1,2-diol is OC[C@@H](O)CN1CCOCC1.
What is the InChIKey of (2S)-3-morpholin-4-ylpropane-1,2-diol?
The InChIKey is VZBNUEHCOOXOHR-ZETCQYMHSA-N. The full InChI is InChI=1S/C7H15NO3/c9-6-7(10)5-8-1-3-11-4-2-8/h7,9-10H,1-6H2/t7-/m0/s1.
What are the key properties of (2S)-3-morpholin-4-ylpropane-1,2-diol?
(2S)-3-morpholin-4-ylpropane-1,2-diol has a molecular weight of 161.20 g/mol, XLogP of -1.33, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-3-morpholin-4-ylpropane-1,2-diol is sourced from PubChem (CID 1268043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).