4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide

C20H20ClN3O2 — CID 55603749

IUPAC4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
SMILESCc1cc2ccccc2n1CC(=O)Nc1cc(C(=O)N(C)C)ccc1Cl
InChIInChI=1S/C20H20ClN3O2/c1-13-10-14-6-4-5-7-18(14)24(13)12-19(25)22-17-11-15(8-9-16(17)21)20(26)23(2)3/h4-11H,12H2,1-3H3,(H,22,25)
InChIKeyFLZKLMVUXNEGMK-UHFFFAOYSA-N
MW369.85 g/mol
LogP3.94
Rot. Bonds4

About 4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide

4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide (PubChem CID 55603749) has the molecular formula C20H20ClN3O2 and a molecular weight of 369.85 g/mol. Its IUPAC name is 4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide.

Molecular Properties

Compound Name4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
PubChem CID55603749
Molecular FormulaC20H20ClN3O2
Molecular Weight369.85 g/mol
Exact Mass369.12
IUPAC Name4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
SMILESCc1cc2ccccc2n1CC(=O)Nc1cc(C(=O)N(C)C)ccc1Cl
InChIInChI=1S/C20H20ClN3O2/c1-13-10-14-6-4-5-7-18(14)24(13)12-19(25)22-17-11-15(8-9-16(17)21)20(26)23(2)3/h4-11H,12H2,1-3H3,(H,22,25)
InChIKeyFLZKLMVUXNEGMK-UHFFFAOYSA-N
XLogP3.94
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.85
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N,N-dimethyl-3-[[2-(methylamino)acetyl]amino]benzamide
CID 43697266
N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-methylindol-1-yl)acetamide
CID 34276921
4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
CID 32513243
N-[2-(2-chloroanilino)-2-oxoethyl]-N-methyl-2-(2-methylindol-1-yl)acetamide
CID 9090072
N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide
CID 4150176
3-[[2-(tert-butylamino)acetyl]amino]-4-chloro-N,N-dimethylbenzamide
CID 78954083
4-chloro-3-[[2-(2-chlorophenyl)acetyl]amino]-N,N-dimethylbenzamide
CID 38957066
2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
CID 30806248
2-(2-methylindol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 51238620
N-[2,5-dimethoxy-4-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]benzamide
CID 26705081
2-(2-methylindol-1-yl)-N-pyridin-4-ylacetamide
CID 27700402
5-[2-chloro-5-(dimethylcarbamoyl)anilino]-5-oxopentanoic acid
CID 60940816

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
The IUPAC name of 4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide (CID 55603749) is 4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide.
What is the SMILES notation for 4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
The canonical SMILES for 4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide is Cc1cc2ccccc2n1CC(=O)Nc1cc(C(=O)N(C)C)ccc1Cl.
What is the InChIKey of 4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
The InChIKey is FLZKLMVUXNEGMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20ClN3O2/c1-13-10-14-6-4-5-7-18(14)24(13)12-19(25)22-17-11-15(8-9-16(17)21)20(26)23(2)3/h4-11H,12H2,1-3H3,(H,22,25).
What are the key properties of 4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide has a molecular weight of 369.85 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide is sourced from PubChem (CID 55603749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).