2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone

C13H17NO3 — CID 142614199

IUPAC2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone
SMILESCc1ccc(CC(=O)N2CCOCC2)c(O)c1
InChIInChI=1S/C13H17NO3/c1-10-2-3-11(12(15)8-10)9-13(16)14-4-6-17-7-5-14/h2-3,8,15H,4-7,9H2,1H3
InChIKeyFRENDMDKDSUXOT-UHFFFAOYSA-N
MW235.28 g/mol
LogP1.10
Rot. Bonds2

About 2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone

2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone (PubChem CID 142614199) has the molecular formula C13H17NO3 and a molecular weight of 235.28 g/mol. Its IUPAC name is 2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone
PubChem CID142614199
Molecular FormulaC13H17NO3
Molecular Weight235.28 g/mol
Exact Mass235.12
IUPAC Name2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone
SMILESCc1ccc(CC(=O)N2CCOCC2)c(O)c1
InChIInChI=1S/C13H17NO3/c1-10-2-3-11(12(15)8-10)9-13(16)14-4-6-17-7-5-14/h2-3,8,15H,4-7,9H2,1H3
InChIKeyFRENDMDKDSUXOT-UHFFFAOYSA-N
XLogP1.10
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanethione
CID 142614303
(2-morpholin-4-yl-2-oxoethyl) 2-hydroxy-4-methylbenzoate
CID 2611661
2-(4-chloro-2-methylphenyl)-1-morpholin-4-ylethanone
CID 67968225
2-hydroxy-4-methyl-N-(3-morpholin-4-yl-3-oxopropyl)benzamide
CID 115581591
(3S)-3-(2-hydroxy-4-methylphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one
CID 740584
2-(2-amino-5-methylphenyl)sulfanyl-1-morpholin-4-ylethanone
CID 79143140
2-(5-methyl-1,3-benzoxazol-2-yl)-1-morpholin-4-ylethanone
CID 54431192
2-(2,4-dimethylphenyl)-1-pyrrolidin-1-ylethanone
CID 95970810
2-(2,5-dimethyl-1H-pyrrol-3-yl)-1-morpholin-4-ylethanone
CID 110773449
2-(2-bromo-5-methyl-1-benzofuran-3-yl)-1-morpholin-4-ylethanone
CID 156620519
(3S)-3-(2-hydroxy-5-methylphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one
CID 40595933
1-[4-(2-hydroxy-5-methylbenzoyl)piperazin-1-yl]-2-morpholin-4-ylethanone
CID 46548530

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone?
The IUPAC name of 2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone (CID 142614199) is 2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone is Cc1ccc(CC(=O)N2CCOCC2)c(O)c1.
What is the InChIKey of 2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone?
The InChIKey is FRENDMDKDSUXOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3/c1-10-2-3-11(12(15)8-10)9-13(16)14-4-6-17-7-5-14/h2-3,8,15H,4-7,9H2,1H3.
What are the key properties of 2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone?
2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone has a molecular weight of 235.28 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-4-methylphenyl)-1-morpholin-4-ylethanone is sourced from PubChem (CID 142614199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).