3-chloro-6-methoxy-2-methylbenzamide

C9H10ClNO2 — CID 171008578

IUPAC3-chloro-6-methoxy-2-methylbenzamide
SMILESCOc1ccc(Cl)c(C)c1C(N)=O
InChIInChI=1S/C9H10ClNO2/c1-5-6(10)3-4-7(13-2)8(5)9(11)12/h3-4H,1-2H3,(H2,11,12)
InChIKeyGMSFSIZYPGWFPD-UHFFFAOYSA-N
MW199.64 g/mol
LogP1.76
Rot. Bonds2

About 3-chloro-6-methoxy-2-methylbenzamide

3-chloro-6-methoxy-2-methylbenzamide (PubChem CID 171008578) has the molecular formula C9H10ClNO2 and a molecular weight of 199.64 g/mol. Its IUPAC name is 3-chloro-6-methoxy-2-methylbenzamide.

Molecular Properties

Compound Name3-chloro-6-methoxy-2-methylbenzamide
PubChem CID171008578
Molecular FormulaC9H10ClNO2
Molecular Weight199.64 g/mol
Exact Mass199.04
IUPAC Name3-chloro-6-methoxy-2-methylbenzamide
SMILESCOc1ccc(Cl)c(C)c1C(N)=O
InChIInChI=1S/C9H10ClNO2/c1-5-6(10)3-4-7(13-2)8(5)9(11)12/h3-4H,1-2H3,(H2,11,12)
InChIKeyGMSFSIZYPGWFPD-UHFFFAOYSA-N
XLogP1.76
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyano-6-methoxy-2-methylbenzamide
CID 171026852
2,4-dichloro-6-methoxybenzamide
CID 118588801
1-chloro-3-iodo-4-methoxy-2-methylbenzene
CID 91025767
3-chloro-2-methyl-6-nitrobenzamide
CID 131072971
methyl 2,6-dichloro-3-methoxybenzoate
CID 72942143
methyl N-(2-carbamoyl-3,6-dimethoxyphenyl)carbamate
CID 134102474
2,6-dimethoxy-3,4-dimethylbenzamide
CID 175082400
methyl 3,6-dimethoxy-2-methylbenzoate
CID 10536412
3,5-dimethoxypyridine-4-carboxamide
CID 69277472
4,8-dimethoxynaphthalene-1,5-dicarboxamide
CID 100971321
4-chloro-2-fluoro-3-methylbenzamide
CID 83385455
3-chloro-2-iodo-6-methylbenzamide
CID 171003854

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-methoxy-2-methylbenzamide?
The IUPAC name of 3-chloro-6-methoxy-2-methylbenzamide (CID 171008578) is 3-chloro-6-methoxy-2-methylbenzamide.
What is the SMILES notation for 3-chloro-6-methoxy-2-methylbenzamide?
The canonical SMILES for 3-chloro-6-methoxy-2-methylbenzamide is COc1ccc(Cl)c(C)c1C(N)=O.
What is the InChIKey of 3-chloro-6-methoxy-2-methylbenzamide?
The InChIKey is GMSFSIZYPGWFPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClNO2/c1-5-6(10)3-4-7(13-2)8(5)9(11)12/h3-4H,1-2H3,(H2,11,12).
What are the key properties of 3-chloro-6-methoxy-2-methylbenzamide?
3-chloro-6-methoxy-2-methylbenzamide has a molecular weight of 199.64 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-methoxy-2-methylbenzamide is sourced from PubChem (CID 171008578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).