(1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol

C13H20N2O2 — CID 96818422

IUPAC(1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol
SMILESNCC[C@@H](O)c1ccccc1N1CCOCC1
InChIInChI=1S/C13H20N2O2/c14-6-5-13(16)11-3-1-2-4-12(11)15-7-9-17-10-8-15/h1-4,13,16H,5-10,14H2/t13-/m1/s1
InChIKeyXHSWVRZZROPBSS-CYBMUJFWSA-N
MW236.31 g/mol
LogP0.91
Rot. Bonds4

About (1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol

(1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol (PubChem CID 96818422) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is (1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol.

Molecular Properties

Compound Name(1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol
PubChem CID96818422
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name(1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol
SMILESNCC[C@@H](O)c1ccccc1N1CCOCC1
InChIInChI=1S/C13H20N2O2/c14-6-5-13(16)11-3-1-2-4-12(11)15-7-9-17-10-8-15/h1-4,13,16H,5-10,14H2/t13-/m1/s1
InChIKeyXHSWVRZZROPBSS-CYBMUJFWSA-N
XLogP0.91
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-1-(2-morpholin-4-ylphenyl)ethanol
CID 82617214
(1R)-1-(2-morpholin-4-ylphenyl)ethanol
CID 78939110
ethoxy-(2-morpholin-4-ylphenyl)methanol
CID 91211184
3-bromo-1-(2-morpholin-4-ylphenyl)propane-1,2-diol
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2-amino-1-(4-methyl-2-morpholin-4-ylphenyl)ethanol
CID 117115348
2-amino-1-(4-fluoro-2-morpholin-4-ylphenyl)ethanol
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2-[3-(2-morpholin-4-ylphenyl)hexan-2-yl]guanidine
CID 174289553
1-(2-morpholin-4-ylphenyl)propan-2-ol
CID 83674895
3-(2-morpholin-4-ylphenyl)butanal
CID 117338487
1-(methylamino)-1-(2-morpholin-4-ylphenyl)butan-2-one
CID 174864806
(1R)-1-(2-piperidin-1-ylphenyl)propan-1-ol
CID 103959701
3-amino-1-(2-propan-2-ylphenyl)propan-1-ol
CID 82605381

Frequently Asked Questions

What is the IUPAC name of (1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol?
The IUPAC name of (1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol (CID 96818422) is (1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol.
What is the SMILES notation for (1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol?
The canonical SMILES for (1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol is NCC[C@@H](O)c1ccccc1N1CCOCC1.
What is the InChIKey of (1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol?
The InChIKey is XHSWVRZZROPBSS-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H20N2O2/c14-6-5-13(16)11-3-1-2-4-12(11)15-7-9-17-10-8-15/h1-4,13,16H,5-10,14H2/t13-/m1/s1.
What are the key properties of (1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol?
(1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol has a molecular weight of 236.31 g/mol, XLogP of 0.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-amino-1-(2-morpholin-4-ylphenyl)propan-1-ol is sourced from PubChem (CID 96818422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).