2,3,4-trimethylbenzamide;hydrochloride

C10H14ClNO — CID 67157686

IUPAC2,3,4-trimethylbenzamide;hydrochloride
SMILESCc1ccc(C(N)=O)c(C)c1C.Cl
InChIInChI=1S/C10H13NO.ClH/c1-6-4-5-9(10(11)12)8(3)7(6)2;/h4-5H,1-3H3,(H2,11,12);1H
InChIKeyJJEIBLBZNCKIMZ-UHFFFAOYSA-N
MW199.68 g/mol
LogP2.13
Rot. Bonds1

About 2,3,4-trimethylbenzamide;hydrochloride

2,3,4-trimethylbenzamide;hydrochloride (PubChem CID 67157686) has the molecular formula C10H14ClNO and a molecular weight of 199.68 g/mol. Its IUPAC name is 2,3,4-trimethylbenzamide;hydrochloride.

Molecular Properties

Compound Name2,3,4-trimethylbenzamide;hydrochloride
PubChem CID67157686
Molecular FormulaC10H14ClNO
Molecular Weight199.68 g/mol
Exact Mass199.08
IUPAC Name2,3,4-trimethylbenzamide;hydrochloride
SMILESCc1ccc(C(N)=O)c(C)c1C.Cl
InChIInChI=1S/C10H13NO.ClH/c1-6-4-5-9(10(11)12)8(3)7(6)2;/h4-5H,1-3H3,(H2,11,12);1H
InChIKeyJJEIBLBZNCKIMZ-UHFFFAOYSA-N
XLogP2.13
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.68
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-fluoro-2,4-dimethylbenzamide
CID 119006165
2,4-dimethylbenzene-1,3-dicarboxamide
CID 19767105
1-(2,3,4-trimethylphenyl)ethanone
CID 590291
2,3-dimethylbenzamide;ethane
CID 143389789
3,4-dimethyl-2-piperidin-4-yloxybenzamide
CID 175125631
3,4-dimethyl-2-propylbenzamide
CID 154390636
2,3-dimethyl-4-propan-2-ylbenzamide
CID 154461721
1-(2,3,4-trimethylphenyl)propan-1-one
CID 19901190
2-carbamoyl-3,4-dimethylbenzoate
CID 22769833
ethyl 2-oxo-2-(2,3,4-trimethylphenyl)acetate
CID 116924381
(2,4-dimethylphenyl)-(2,3,4-trimethylphenyl)methanone
CID 70628642
3,4-dimethyl-2-morpholin-4-ylbenzamide
CID 155069283

Frequently Asked Questions

What is the IUPAC name of 2,3,4-trimethylbenzamide;hydrochloride?
The IUPAC name of 2,3,4-trimethylbenzamide;hydrochloride (CID 67157686) is 2,3,4-trimethylbenzamide;hydrochloride.
What is the SMILES notation for 2,3,4-trimethylbenzamide;hydrochloride?
The canonical SMILES for 2,3,4-trimethylbenzamide;hydrochloride is Cc1ccc(C(N)=O)c(C)c1C.Cl.
What is the InChIKey of 2,3,4-trimethylbenzamide;hydrochloride?
The InChIKey is JJEIBLBZNCKIMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO.ClH/c1-6-4-5-9(10(11)12)8(3)7(6)2;/h4-5H,1-3H3,(H2,11,12);1H.
What are the key properties of 2,3,4-trimethylbenzamide;hydrochloride?
2,3,4-trimethylbenzamide;hydrochloride has a molecular weight of 199.68 g/mol, XLogP of 2.13, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trimethylbenzamide;hydrochloride is sourced from PubChem (CID 67157686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).