N-(3-chloro-2,4-dimethoxyphenyl)acetamide

C10H12ClNO3 — CID 91691937

IUPACN-(3-chloro-2,4-dimethoxyphenyl)acetamide
SMILESCOc1ccc(NC(C)=O)c(OC)c1Cl
InChIInChI=1S/C10H12ClNO3/c1-6(13)12-7-4-5-8(14-2)9(11)10(7)15-3/h4-5H,1-3H3,(H,12,13)
InChIKeyQMRQXZJLDCIEPQ-UHFFFAOYSA-N
MW229.66 g/mol
LogP2.32
Rot. Bonds3

About N-(3-chloro-2,4-dimethoxyphenyl)acetamide

N-(3-chloro-2,4-dimethoxyphenyl)acetamide (PubChem CID 91691937) has the molecular formula C10H12ClNO3 and a molecular weight of 229.66 g/mol. Its IUPAC name is N-(3-chloro-2,4-dimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(3-chloro-2,4-dimethoxyphenyl)acetamide
PubChem CID91691937
Molecular FormulaC10H12ClNO3
Molecular Weight229.66 g/mol
Exact Mass229.05
IUPAC NameN-(3-chloro-2,4-dimethoxyphenyl)acetamide
SMILESCOc1ccc(NC(C)=O)c(OC)c1Cl
InChIInChI=1S/C10H12ClNO3/c1-6(13)12-7-4-5-8(14-2)9(11)10(7)15-3/h4-5H,1-3H3,(H,12,13)
InChIKeyQMRQXZJLDCIEPQ-UHFFFAOYSA-N
XLogP2.32
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.66
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-methoxyphenyl)acetamide
CID 593884
1-(2,3-dichloro-4-methoxyphenyl)-3-methylurea
CID 115168935
N-(2,4-dimethoxy-3-methylphenyl)carbamoyl chloride
CID 115194384
(2,6-dichloro-3-methoxyphenyl) acetate
CID 57203396
N-(2-chloro-4,5-dimethoxyphenyl)acetamide
CID 60709552
N-(4-formyl-2,3-dimethoxyphenyl)acetamide
CID 84788904
N-(4-chloro-2,3-dimethoxyphenyl)-2-[(2-chloro-3,6-dimethoxyphenyl)diazenyl]-3-oxobutanamide
CID 101329088
3-(3-chloro-2,4-dimethoxyanilino)-1-thiophen-2-ylpropan-1-one
CID 676240
N-(5-iodo-2-methoxyphenyl)acetamide
CID 11737859
1-bromo-3-chloro-2,4-dimethoxybenzene
CID 53217015
N-(2,4,5-trimethoxyphenyl)acetamide
CID 54074808
N-(2,4-dimethoxy-3-methylphenyl)-2-oxoacetamide
CID 115165932

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2,4-dimethoxyphenyl)acetamide?
The IUPAC name of N-(3-chloro-2,4-dimethoxyphenyl)acetamide (CID 91691937) is N-(3-chloro-2,4-dimethoxyphenyl)acetamide.
What is the SMILES notation for N-(3-chloro-2,4-dimethoxyphenyl)acetamide?
The canonical SMILES for N-(3-chloro-2,4-dimethoxyphenyl)acetamide is COc1ccc(NC(C)=O)c(OC)c1Cl.
What is the InChIKey of N-(3-chloro-2,4-dimethoxyphenyl)acetamide?
The InChIKey is QMRQXZJLDCIEPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO3/c1-6(13)12-7-4-5-8(14-2)9(11)10(7)15-3/h4-5H,1-3H3,(H,12,13).
What are the key properties of N-(3-chloro-2,4-dimethoxyphenyl)acetamide?
N-(3-chloro-2,4-dimethoxyphenyl)acetamide has a molecular weight of 229.66 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2,4-dimethoxyphenyl)acetamide is sourced from PubChem (CID 91691937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).