N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide

C17H12Cl2N2O2 — CID 18367912

IUPACN-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide
SMILESCC(=O)Nc1c(C(=O)c2cccc(Cl)c2)[nH]c2cc(Cl)ccc12
InChIInChI=1S/C17H12Cl2N2O2/c1-9(22)20-15-13-6-5-12(19)8-14(13)21-16(15)17(23)10-3-2-4-11(18)7-10/h2-8,21H,1H3,(H,20,22)
InChIKeyIGASGUVSVZVKNR-UHFFFAOYSA-N
MW347.20 g/mol
LogP4.66
Rot. Bonds3

About N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide

N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide (PubChem CID 18367912) has the molecular formula C17H12Cl2N2O2 and a molecular weight of 347.20 g/mol. Its IUPAC name is N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide.

Molecular Properties

Compound NameN-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide
PubChem CID18367912
Molecular FormulaC17H12Cl2N2O2
Molecular Weight347.20 g/mol
Exact Mass346.03
IUPAC NameN-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide
SMILESCC(=O)Nc1c(C(=O)c2cccc(Cl)c2)[nH]c2cc(Cl)ccc12
InChIInChI=1S/C17H12Cl2N2O2/c1-9(22)20-15-13-6-5-12(19)8-14(13)21-16(15)17(23)10-3-2-4-11(18)7-10/h2-8,21H,1H3,(H,20,22)
InChIKeyIGASGUVSVZVKNR-UHFFFAOYSA-N
XLogP4.66
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.20
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[6-chloro-2-(3-hydroxybenzoyl)-1H-indol-3-yl]acetamide
CID 18368034
N-[6-chloro-2-(4-methoxybenzoyl)-1H-indol-3-yl]acetamide
CID 18367767
N-(2-benzoyl-6-chloro-1H-indol-3-yl)-3-oxobutanamide
CID 18368229
N-[6-chloro-2-(4-chloropyridine-2-carbonyl)-1H-indol-3-yl]acetamide
CID 18368040
N-(2-benzoyl-6-chloro-1H-indol-3-yl)-2,2,2-trichloroacetamide
CID 18368099
N-(2-benzoyl-6-chloro-1H-indol-3-yl)-4-tert-butylbenzamide
CID 18368116
N-(2-benzoyl-6-fluoro-1H-indol-3-yl)acetamide
CID 18368049
N-(2-benzoyl-6-chloro-1H-indol-3-yl)-4-methoxybenzamide
CID 18367863
N-(2-benzoyl-6-chloro-1H-indol-3-yl)-2-chloro-6-fluorobenzamide
CID 18367804
N-(2-benzoyl-6-chloro-1H-indol-3-yl)-2-bromobenzamide
CID 18368226
[3-(5-bromopentylamino)-6-chloro-1H-indol-2-yl]-phenylmethanone
CID 57250038
N-(2-benzoyl-6-chloro-1H-indol-3-yl)-4-cyanobenzamide
CID 18368131

Frequently Asked Questions

What is the IUPAC name of N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide?
The IUPAC name of N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide (CID 18367912) is N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide.
What is the SMILES notation for N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide?
The canonical SMILES for N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide is CC(=O)Nc1c(C(=O)c2cccc(Cl)c2)[nH]c2cc(Cl)ccc12.
What is the InChIKey of N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide?
The InChIKey is IGASGUVSVZVKNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N2O2/c1-9(22)20-15-13-6-5-12(19)8-14(13)21-16(15)17(23)10-3-2-4-11(18)7-10/h2-8,21H,1H3,(H,20,22).
What are the key properties of N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide?
N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide has a molecular weight of 347.20 g/mol, XLogP of 4.66, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-chloro-2-(3-chlorobenzoyl)-1H-indol-3-yl]acetamide is sourced from PubChem (CID 18367912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).