N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide

C20H24N2O3 — CID 95327413

IUPACN-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide
SMILESO=C(NC[C@H](O)Cc1ccccc1)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C20H24N2O3/c23-19(14-16-4-2-1-3-5-16)15-21-20(24)17-6-8-18(9-7-17)22-10-12-25-13-11-22/h1-9,19,23H,10-15H2,(H,21,24)/t19-/m1/s1
InChIKeyUMNOPANKKRMUSQ-LJQANCHMSA-N
MW340.42 g/mol
LogP1.86
Rot. Bonds6

About N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide

N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide (PubChem CID 95327413) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide.

Molecular Properties

Compound NameN-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide
PubChem CID95327413
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide
SMILESO=C(NC[C@H](O)Cc1ccccc1)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C20H24N2O3/c23-19(14-16-4-2-1-3-5-16)15-21-20(24)17-6-8-18(9-7-17)22-10-12-25-13-11-22/h1-9,19,23H,10-15H2,(H,21,24)/t19-/m1/s1
InChIKeyUMNOPANKKRMUSQ-LJQANCHMSA-N
XLogP1.86
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-3-phenylpropyl)-4-(1,2,4-triazol-1-yl)benzamide
CID 111102425
N-(2-hydroxy-3-phenylpropyl)-5-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide
CID 56747995
4-(cyclopropanecarbonylamino)-N-(2-hydroxy-3-phenylpropyl)benzamide
CID 111102382
N-[(2S)-2-hydroxy-3-phenylpropyl]-2-(1-morpholin-4-ylcyclopentyl)acetamide
CID 97081899
N-(2,2-dimethylpropyl)-4-morpholin-4-ylbenzamide
CID 110474046
N-[(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-4-morpholin-4-ylbenzamide
CID 42432750
4-amino-2,2-dimethyl-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one
CID 68890716
2-methyl-3-[4-[(4-morpholin-4-ylbenzoyl)amino]phenyl]propanoic acid
CID 120541058
2-ethylsulfanyl-N-(2-hydroxy-3-phenylpropyl)-4-methyl-6-morpholin-4-ylpyridine-3-carboxamide
CID 56963517
2-chloro-N-[4-[(2-hydroxy-3-phenylpropyl)carbamoyl]phenyl]benzamide
CID 91343467
N-(2-hydroxy-3-isoquinolin-3-ylpropyl)-4-(morpholine-4-carbonyl)benzamide
CID 118929954
1-benzyl-N-(2-hydroxy-3-phenylpropyl)pyrazole-4-carboxamide
CID 111102491

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide?
The IUPAC name of N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide (CID 95327413) is N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide.
What is the SMILES notation for N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide?
The canonical SMILES for N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide is O=C(NC[C@H](O)Cc1ccccc1)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide?
The InChIKey is UMNOPANKKRMUSQ-LJQANCHMSA-N. The full InChI is InChI=1S/C20H24N2O3/c23-19(14-16-4-2-1-3-5-16)15-21-20(24)17-6-8-18(9-7-17)22-10-12-25-13-11-22/h1-9,19,23H,10-15H2,(H,21,24)/t19-/m1/s1.
What are the key properties of N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide?
N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide has a molecular weight of 340.42 g/mol, XLogP of 1.86, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-hydroxy-3-phenylpropyl]-4-morpholin-4-ylbenzamide is sourced from PubChem (CID 95327413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).