4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide

C22H25N3O4 — CID 32513243

IUPAC4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
SMILESCOc1cc(NC(=O)Cn2c(C)cc3ccccc32)c(C(=O)N(C)C)cc1OC
InChIInChI=1S/C22H25N3O4/c1-14-10-15-8-6-7-9-18(15)25(14)13-21(26)23-17-12-20(29-5)19(28-4)11-16(17)22(27)24(2)3/h6-12H,13H2,1-5H3,(H,23,26)
InChIKeyKGQTXNXGUGIKBU-UHFFFAOYSA-N
MW395.46 g/mol
LogP3.31
Rot. Bonds6

About 4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide

4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide (PubChem CID 32513243) has the molecular formula C22H25N3O4 and a molecular weight of 395.46 g/mol. Its IUPAC name is 4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide.

Molecular Properties

Compound Name4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
PubChem CID32513243
Molecular FormulaC22H25N3O4
Molecular Weight395.46 g/mol
Exact Mass395.18
IUPAC Name4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
SMILESCOc1cc(NC(=O)Cn2c(C)cc3ccccc32)c(C(=O)N(C)C)cc1OC
InChIInChI=1S/C22H25N3O4/c1-14-10-15-8-6-7-9-18(15)25(14)13-21(26)23-17-12-20(29-5)19(28-4)11-16(17)22(27)24(2)3/h6-12H,13H2,1-5H3,(H,23,26)
InChIKeyKGQTXNXGUGIKBU-UHFFFAOYSA-N
XLogP3.31
TPSA72.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2,5-dimethoxy-4-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]benzamide
CID 26705081
N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide
CID 17419691
4-chloro-N,N-dimethyl-3-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
CID 55603749
N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-2-(2-methylindol-1-yl)acetamide
CID 47014489
N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide
CID 4150176
4,5-dimethoxy-N,N-dimethyl-2-(4-methylpentanoylamino)benzamide
CID 32511429
N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-methylindol-1-yl)acetamide
CID 34276921
N-[2-(4-methoxyphenyl)ethyl]-2-(2-methylindol-1-yl)acetamide
CID 26586028
N-(2-methoxyphenyl)-2-[[2-(3-methyl-1-oxoisoquinolin-2-yl)acetyl]amino]acetamide
CID 15993533
4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methyl-N-methylsulfonylanilino)acetyl]amino]benzamide
CID 32511900
N-(4-bromophenyl)-2-(2-methylindol-1-yl)acetamide
CID 4226117
2-(2-methylindol-1-yl)-N-pyridin-4-ylacetamide
CID 27700402

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
The IUPAC name of 4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide (CID 32513243) is 4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide.
What is the SMILES notation for 4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
The canonical SMILES for 4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide is COc1cc(NC(=O)Cn2c(C)cc3ccccc32)c(C(=O)N(C)C)cc1OC.
What is the InChIKey of 4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
The InChIKey is KGQTXNXGUGIKBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O4/c1-14-10-15-8-6-7-9-18(15)25(14)13-21(26)23-17-12-20(29-5)19(28-4)11-16(17)22(27)24(2)3/h6-12H,13H2,1-5H3,(H,23,26).
What are the key properties of 4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide?
4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide has a molecular weight of 395.46 g/mol, XLogP of 3.31, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide is sourced from PubChem (CID 32513243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).