N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide

C19H19ClN2O3 — CID 20851579

IUPACN-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide
SMILESCOc1cc(OC)c(NC(=O)Cc2cn(C)c3ccccc23)cc1Cl
InChIInChI=1S/C19H19ClN2O3/c1-22-11-12(13-6-4-5-7-16(13)22)8-19(23)21-15-9-14(20)17(24-2)10-18(15)25-3/h4-7,9-11H,8H2,1-3H3,(H,21,23)
InChIKeyMLQWIWGLWAXAFA-UHFFFAOYSA-N
MW358.83 g/mol
LogP4.03
Rot. Bonds5

About N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide

N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide (PubChem CID 20851579) has the molecular formula C19H19ClN2O3 and a molecular weight of 358.83 g/mol. Its IUPAC name is N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide
PubChem CID20851579
Molecular FormulaC19H19ClN2O3
Molecular Weight358.83 g/mol
Exact Mass358.11
IUPAC NameN-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide
SMILESCOc1cc(OC)c(NC(=O)Cc2cn(C)c3ccccc23)cc1Cl
InChIInChI=1S/C19H19ClN2O3/c1-22-11-12(13-6-4-5-7-16(13)22)8-19(23)21-15-9-14(20)17(24-2)10-18(15)25-3/h4-7,9-11H,8H2,1-3H3,(H,21,23)
InChIKeyMLQWIWGLWAXAFA-UHFFFAOYSA-N
XLogP4.03
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.83
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-oxoquinolin-1-yl)acetamide
CID 47780117
N-(2-ethylphenyl)-2-(1-methylindol-3-yl)acetamide
CID 4523543
1-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-4-oxoquinoline-3-carboxylic acid
CID 155322891
methyl 4-[[2-(1-methylindol-3-yl)acetyl]amino]piperidine-1-carboxylate
CID 86859520
N-(5-chloro-2,4-dimethoxyphenyl)-3-oxo-3-phenylpropanamide
CID 2220274
N-(5-chloro-2-pyridinyl)-2-(1-methylindol-3-yl)acetamide
CID 4568690
N-(5-chloro-2,4-dimethoxyphenyl)-2-methoxyacetamide
CID 836298
2-amino-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
CID 24690060
N-(2-methoxyethyl)-2-(1-methylindol-3-yl)acetamide
CID 3237946
N-(5-chloro-2,4-dimethoxyphenyl)naphthalene-1-carboxamide
CID 823910
N-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-N-methylbenzamide
CID 35678379
N-(5-chloro-2,4-dimethoxyphenyl)-3-[(2-phenylacetyl)amino]propanamide
CID 51310881

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide?
The IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide (CID 20851579) is N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide.
What is the SMILES notation for N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide?
The canonical SMILES for N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide is COc1cc(OC)c(NC(=O)Cc2cn(C)c3ccccc23)cc1Cl.
What is the InChIKey of N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide?
The InChIKey is MLQWIWGLWAXAFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O3/c1-22-11-12(13-6-4-5-7-16(13)22)8-19(23)21-15-9-14(20)17(24-2)10-18(15)25-3/h4-7,9-11H,8H2,1-3H3,(H,21,23).
What are the key properties of N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide?
N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide has a molecular weight of 358.83 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2,4-dimethoxyphenyl)-2-(1-methylindol-3-yl)acetamide is sourced from PubChem (CID 20851579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).