2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide

C18H16ClN3O2 — CID 30806248

IUPAC2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
SMILESCc1cc2ccccc2n1CC(=O)Nc1ccc(Cl)c(C(N)=O)c1
InChIInChI=1S/C18H16ClN3O2/c1-11-8-12-4-2-3-5-16(12)22(11)10-17(23)21-13-6-7-15(19)14(9-13)18(20)24/h2-9H,10H2,1H3,(H2,20,24)(H,21,23)
InChIKeyFYMJMMSKYIVMCV-UHFFFAOYSA-N
MW341.80 g/mol
LogP3.34
Rot. Bonds4

About 2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide

2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide (PubChem CID 30806248) has the molecular formula C18H16ClN3O2 and a molecular weight of 341.80 g/mol. Its IUPAC name is 2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide.

Molecular Properties

Compound Name2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
PubChem CID30806248
Molecular FormulaC18H16ClN3O2
Molecular Weight341.80 g/mol
Exact Mass341.09
IUPAC Name2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
SMILESCc1cc2ccccc2n1CC(=O)Nc1ccc(Cl)c(C(N)=O)c1
InChIInChI=1S/C18H16ClN3O2/c1-11-8-12-4-2-3-5-16(12)22(11)10-17(23)21-13-6-7-15(19)14(9-13)18(20)24/h2-9H,10H2,1H3,(H2,20,24)(H,21,23)
InChIKeyFYMJMMSKYIVMCV-UHFFFAOYSA-N
XLogP3.34
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.80
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylindol-1-yl)-N-pyridin-4-ylacetamide
CID 27700402
N-(4-bromophenyl)-2-(2-methylindol-1-yl)acetamide
CID 4226117
N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide
CID 4150176
2-methyl-4-[[2-(2-phenylindol-1-yl)acetyl]amino]benzamide
CID 56518035
2-chloro-5-[[2-(2,6-dimethyl-4-oxo-1-pyridinyl)acetyl]amino]benzoic acid
CID 108806419
4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
CID 55603749
N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-methylindol-1-yl)acetamide
CID 34276921
N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide
CID 17419691
N-[3-(dimethylsulfamoyl)phenyl]-2-(2-methylindol-1-yl)acetamide
CID 26689900
2-(2-methylindol-1-yl)-N-(6-methyl-2-pyridinyl)acetamide
CID 4173283
2-(2-methylindol-1-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 17460159
N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide
CID 17492691

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
The IUPAC name of 2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide (CID 30806248) is 2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide.
What is the SMILES notation for 2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
The canonical SMILES for 2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide is Cc1cc2ccccc2n1CC(=O)Nc1ccc(Cl)c(C(N)=O)c1.
What is the InChIKey of 2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
The InChIKey is FYMJMMSKYIVMCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClN3O2/c1-11-8-12-4-2-3-5-16(12)22(11)10-17(23)21-13-6-7-15(19)14(9-13)18(20)24/h2-9H,10H2,1H3,(H2,20,24)(H,21,23).
What are the key properties of 2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide has a molecular weight of 341.80 g/mol, XLogP of 3.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide is sourced from PubChem (CID 30806248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).