N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide

C18H17ClN2O2 — CID 110768340

IUPACN-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)Cc1ccc2c(c1)CC(=O)N2C
InChIInChI=1S/C18H17ClN2O2/c1-11-7-14(19)4-5-15(11)20-17(22)9-12-3-6-16-13(8-12)10-18(23)21(16)2/h3-8H,9-10H2,1-2H3,(H,20,22)
InChIKeyZVDLKSBQJNUZKV-UHFFFAOYSA-N
MW328.80 g/mol
LogP3.35
Rot. Bonds3

About N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide

N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide (PubChem CID 110768340) has the molecular formula C18H17ClN2O2 and a molecular weight of 328.80 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide
PubChem CID110768340
Molecular FormulaC18H17ClN2O2
Molecular Weight328.80 g/mol
Exact Mass328.10
IUPAC NameN-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)Cc1ccc2c(c1)CC(=O)N2C
InChIInChI=1S/C18H17ClN2O2/c1-11-7-14(19)4-5-15(11)20-17(22)9-12-3-6-16-13(8-12)10-18(23)21(16)2/h3-8H,9-10H2,1-2H3,(H,20,22)
InChIKeyZVDLKSBQJNUZKV-UHFFFAOYSA-N
XLogP3.35
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.80
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,4-dimethylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide
CID 110768321
N-(2-aminoethyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide
CID 82295802
2-(1-methyl-2-oxo-3H-indol-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 110768380
2-(4-chlorophenyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 17484787
N-(4-chloro-2-methylphenyl)-N'-(2,4-dichlorophenyl)propanediamide
CID 108955225
N-[2-(1-methyl-2-oxo-3H-indol-5-yl)ethyl]carbamoyl chloride
CID 115194905
N-(1-methyl-2-oxo-3H-indol-5-yl)carbamoyl chloride
CID 115194357
1-methyl-5-(3-oxobutyl)-3H-indol-2-one
CID 82471813
2-(1-methyl-2-oxo-3H-indol-5-yl)-N-(2-phenylethyl)acetamide
CID 110768281
N-(5-chloro-2-methylphenyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide
CID 110772315
N-(4-chloro-2-methylphenyl)-2-(2-oxopiperidin-1-yl)acetamide
CID 86930614
N-[(1-methyl-2-oxo-3H-indol-5-yl)methyl]carbamoyl bromide
CID 115193579

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide (CID 110768340) is N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide is Cc1cc(Cl)ccc1NC(=O)Cc1ccc2c(c1)CC(=O)N2C.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide?
The InChIKey is ZVDLKSBQJNUZKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2O2/c1-11-7-14(19)4-5-15(11)20-17(22)9-12-3-6-16-13(8-12)10-18(23)21(16)2/h3-8H,9-10H2,1-2H3,(H,20,22).
What are the key properties of N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide?
N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide has a molecular weight of 328.80 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-2-(1-methyl-2-oxo-3H-indol-5-yl)acetamide is sourced from PubChem (CID 110768340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).