2-hydroxy-3,6-dimethylbenzamide

C9H11NO2 — CID 82266966

IUPAC2-hydroxy-3,6-dimethylbenzamide
SMILESCc1ccc(C)c(C(N)=O)c1O
InChIInChI=1S/C9H11NO2/c1-5-3-4-6(2)8(11)7(5)9(10)12/h3-4,11H,1-2H3,(H2,10,12)
InChIKeyIRLRXPWMGNVSHD-UHFFFAOYSA-N
MW165.19 g/mol
LogP1.11
Rot. Bonds1

About 2-hydroxy-3,6-dimethylbenzamide

2-hydroxy-3,6-dimethylbenzamide (PubChem CID 82266966) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is 2-hydroxy-3,6-dimethylbenzamide.

Molecular Properties

Compound Name2-hydroxy-3,6-dimethylbenzamide
PubChem CID82266966
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC Name2-hydroxy-3,6-dimethylbenzamide
SMILESCc1ccc(C)c(C(N)=O)c1O
InChIInChI=1S/C9H11NO2/c1-5-3-4-6(2)8(11)7(5)9(10)12/h3-4,11H,1-2H3,(H2,10,12)
InChIKeyIRLRXPWMGNVSHD-UHFFFAOYSA-N
XLogP1.11
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dimethylbenzene-1,3-dicarboxamide
CID 19767105
2-hydroxy-N,3,6-trimethylbenzamide
CID 89102657
3-chloro-6-methyl-2-sulfanylbenzamide
CID 174522817
3-chloro-2-iodo-6-methylbenzamide
CID 171003854
2-carbamoyl-3,4-dimethylbenzoate
CID 22769833
2-bromo-3-iodo-6-methylbenzamide
CID 171033336
2,3-diethyl-6-methylbenzamide
CID 174760493
3-hydroxy-4-methylphthalic acid
CID 139814560
2-amino-6-methyl-3-(4-methylphenyl)benzamide
CID 18428316
2,6-dimethyl-3-nitrobenzamide
CID 118992531
3-tert-butyl-2-fluoro-6-methylbenzamide
CID 122604245
2,4-dimethyl-1-oxidopyridin-1-ium-3-carboxamide
CID 90971417

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3,6-dimethylbenzamide?
The IUPAC name of 2-hydroxy-3,6-dimethylbenzamide (CID 82266966) is 2-hydroxy-3,6-dimethylbenzamide.
What is the SMILES notation for 2-hydroxy-3,6-dimethylbenzamide?
The canonical SMILES for 2-hydroxy-3,6-dimethylbenzamide is Cc1ccc(C)c(C(N)=O)c1O.
What is the InChIKey of 2-hydroxy-3,6-dimethylbenzamide?
The InChIKey is IRLRXPWMGNVSHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2/c1-5-3-4-6(2)8(11)7(5)9(10)12/h3-4,11H,1-2H3,(H2,10,12).
What are the key properties of 2-hydroxy-3,6-dimethylbenzamide?
2-hydroxy-3,6-dimethylbenzamide has a molecular weight of 165.19 g/mol, XLogP of 1.11, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3,6-dimethylbenzamide is sourced from PubChem (CID 82266966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).