(2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one

C8H15NO3 — CID 69457105

IUPAC(2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one
SMILESCC[C@@H](O)C(=O)N1CCOCC1
InChIInChI=1S/C8H15NO3/c1-2-7(10)8(11)9-3-5-12-6-4-9/h7,10H,2-6H2,1H3/t7-/m1/s1
InChIKeyBXMDPDIKIGETOG-SSDOTTSWSA-N
MW173.21 g/mol
LogP-0.38
Rot. Bonds2

About (2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one

(2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one (PubChem CID 69457105) has the molecular formula C8H15NO3 and a molecular weight of 173.21 g/mol. Its IUPAC name is (2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one.

Molecular Properties

Compound Name(2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one
PubChem CID69457105
Molecular FormulaC8H15NO3
Molecular Weight173.21 g/mol
Exact Mass173.11
IUPAC Name(2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one
SMILESCC[C@@H](O)C(=O)N1CCOCC1
InChIInChI=1S/C8H15NO3/c1-2-7(10)8(11)9-3-5-12-6-4-9/h7,10H,2-6H2,1H3/t7-/m1/s1
InChIKeyBXMDPDIKIGETOG-SSDOTTSWSA-N
XLogP-0.38
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-1-morpholin-4-ylbutan-1-one
CID 62226878
2-isocyano-1-morpholin-4-ylbutan-1-one
CID 134865549
(2-hydroxy-3-morpholin-4-yl-3-oxopropyl)carbamic acid
CID 68502094
(2S)-2-hydroxy-3-methyl-1-morpholin-4-ylbutan-1-one
CID 69460030
1-O-ethyl 4-O-(2-hydroxy-3-morpholin-4-yl-3-oxopropyl) (E)-but-2-enedioate
CID 122667400
2-hydroxy-1-(3-methylpyrrolidin-1-yl)butan-1-one
CID 126991157
[(2R,3R)-3-methyl-1-oxo-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pentan-2-yl]azanium
CID 7452509
2-hydroxy-1-morpholin-4-yl-4-phenylbutan-1-one
CID 76792666
(2S)-3-cyclohexyl-2-hydroxy-1-morpholin-4-ylpropan-1-one
CID 59949122
(2S)-2-chloro-1-morpholin-4-ylpropan-1-one
CID 2434799
2-hydroxy-3-morpholin-4-yl-3-oxopropanoic acid
CID 140976949
(2S)-1-morpholin-4-yl-2-phenylbutan-1-one
CID 670056

Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one?
The IUPAC name of (2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one (CID 69457105) is (2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one.
What is the SMILES notation for (2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one?
The canonical SMILES for (2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one is CC[C@@H](O)C(=O)N1CCOCC1.
What is the InChIKey of (2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one?
The InChIKey is BXMDPDIKIGETOG-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H15NO3/c1-2-7(10)8(11)9-3-5-12-6-4-9/h7,10H,2-6H2,1H3/t7-/m1/s1.
What are the key properties of (2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one?
(2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one has a molecular weight of 173.21 g/mol, XLogP of -0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one is sourced from PubChem (CID 69457105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).