2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide

C12H16N2O3 — CID 78910153

IUPAC2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide
SMILESCc1cccc(C(=O)NN2CCOCC2)c1O
InChIInChI=1S/C12H16N2O3/c1-9-3-2-4-10(11(9)15)12(16)13-14-5-7-17-8-6-14/h2-4,15H,5-8H2,1H3,(H,13,16)
InChIKeyPMPMDEDEXOQOIX-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.68
Rot. Bonds2

About 2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide

2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide (PubChem CID 78910153) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide.

Molecular Properties

Compound Name2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide
PubChem CID78910153
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC Name2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide
SMILESCc1cccc(C(=O)NN2CCOCC2)c1O
InChIInChI=1S/C12H16N2O3/c1-9-3-2-4-10(11(9)15)12(16)13-14-5-7-17-8-6-14/h2-4,15H,5-8H2,1H3,(H,13,16)
InChIKeyPMPMDEDEXOQOIX-UHFFFAOYSA-N
XLogP0.68
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(morpholin-4-ylcarbamoyl)benzoic acid
CID 83004357
3-(4-hydroxybut-1-ynyl)-2-methyl-N-morpholin-4-ylbenzamide
CID 83015256
2-(2-aminoethyl)-N-morpholin-4-ylbenzamide
CID 83016133
N-(5-chloro-2-morpholin-4-ylphenyl)-2-hydroxy-3-methylbenzamide
CID 112809703
4-[(2-hydroxy-3-methylbenzoyl)amino]oxane-4-carboxylic acid
CID 115291380
5-(3-hydroxyprop-1-ynyl)-2-methyl-N-morpholin-4-ylbenzamide
CID 83023821
2-amino-5-hydroxy-N-morpholin-4-ylbenzamide
CID 107075854
2-(ethylamino)-4-methyl-N-morpholin-4-ylbenzamide
CID 83024771
5-methyl-N-morpholin-4-ylfuran-2-carboxamide
CID 3507503
3-hydroxy-N-morpholin-4-ylpyridine-4-carboxamide
CID 80706511
hydrogen peroxide;2-hydroxy-3-methylbenzoic acid
CID 161037568
(2-hydroxy-3-methylphenyl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone
CID 63527838

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide?
The IUPAC name of 2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide (CID 78910153) is 2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide.
What is the SMILES notation for 2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide?
The canonical SMILES for 2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide is Cc1cccc(C(=O)NN2CCOCC2)c1O.
What is the InChIKey of 2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide?
The InChIKey is PMPMDEDEXOQOIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-9-3-2-4-10(11(9)15)12(16)13-14-5-7-17-8-6-14/h2-4,15H,5-8H2,1H3,(H,13,16).
What are the key properties of 2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide?
2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide has a molecular weight of 236.27 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-methyl-N-morpholin-4-ylbenzamide is sourced from PubChem (CID 78910153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).