N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide

C19H17Cl2N3O2 — CID 25313237

IUPACN-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide
SMILESCCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C19H17Cl2N3O2/c1-2-24(11-17(25)23-18-13(20)7-5-8-14(18)21)19(26)16-10-12-6-3-4-9-15(12)22-16/h3-10,22H,2,11H2,1H3,(H,23,25)
InChIKeyNYXQJGMYXDZQFN-UHFFFAOYSA-N
MW390.27 g/mol
LogP4.58
Rot. Bonds5

About N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide

N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide (PubChem CID 25313237) has the molecular formula C19H17Cl2N3O2 and a molecular weight of 390.27 g/mol. Its IUPAC name is N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide
PubChem CID25313237
Molecular FormulaC19H17Cl2N3O2
Molecular Weight390.27 g/mol
Exact Mass389.07
IUPAC NameN-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide
SMILESCCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C19H17Cl2N3O2/c1-2-24(11-17(25)23-18-13(20)7-5-8-14(18)21)19(26)16-10-12-6-3-4-9-15(12)22-16/h3-10,22H,2,11H2,1H3,(H,23,25)
InChIKeyNYXQJGMYXDZQFN-UHFFFAOYSA-N
XLogP4.58
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.27
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide
CID 103103798
2-bromo-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethylbenzamide
CID 34169565
5-chloro-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]-1H-indole-2-carboxamide
CID 38805224
N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide
CID 43421005
2-chloro-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-4-fluorobenzamide
CID 34169732
4-tert-butyl-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethylbenzamide
CID 25313738
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-4-phenoxybenzamide
CID 25313751
N-ethyl-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
CID 33032265
N-ethyl-N-methyl-1H-indole-2-carboxamide
CID 43421002
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-6-oxo-1H-pyridazine-3-carboxamide
CID 31713038
5-chloro-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1H-indole-2-carboxamide
CID 134002575
2-tert-butyl-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-4-methyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 137016807

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide?
The IUPAC name of N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide (CID 25313237) is N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide?
The canonical SMILES for N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide is CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1cc2ccccc2[nH]1.
What is the InChIKey of N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide?
The InChIKey is NYXQJGMYXDZQFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17Cl2N3O2/c1-2-24(11-17(25)23-18-13(20)7-5-8-14(18)21)19(26)16-10-12-6-3-4-9-15(12)22-16/h3-10,22H,2,11H2,1H3,(H,23,25).
What are the key properties of N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide?
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide has a molecular weight of 390.27 g/mol, XLogP of 4.58, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide is sourced from PubChem (CID 25313237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).