2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide

C20H22N2O3 — CID 17271734

IUPAC2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
SMILESCOc1cccc(OC)c1C(=O)NCCc1c[nH]c2ccc(C)cc12
InChIInChI=1S/C20H22N2O3/c1-13-7-8-16-15(11-13)14(12-22-16)9-10-21-20(23)19-17(24-2)5-4-6-18(19)25-3/h4-8,11-12,22H,9-10H2,1-3H3,(H,21,23)
InChIKeyQGIHLSHKPKKLNC-UHFFFAOYSA-N
MW338.41 g/mol
LogP3.47
Rot. Bonds6

About 2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide

2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide (PubChem CID 17271734) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
PubChem CID17271734
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
SMILESCOc1cccc(OC)c1C(=O)NCCc1c[nH]c2ccc(C)cc12
InChIInChI=1S/C20H22N2O3/c1-13-7-8-16-15(11-13)14(12-22-16)9-10-21-20(23)19-17(24-2)5-4-6-18(19)25-3/h4-8,11-12,22H,9-10H2,1-3H3,(H,21,23)
InChIKeyQGIHLSHKPKKLNC-UHFFFAOYSA-N
XLogP3.47
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
CID 17271778
5-chloro-2-methoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide
CID 2988910
N-[2-(1H-indol-3-yl)ethyl]-2-methoxy-5-methylbenzamide
CID 17433152
2-methoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]acetamide
CID 17271899
4,5-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]-2-nitrobenzamide
CID 17271828
2-chloro-N-[2-(5-methyl-1H-indol-3-yl)ethyl]acetamide
CID 17339304
N-[2-(1H-indol-3-yl)ethyl]-3,5-dimethyl-1H-indole-2-carboxamide
CID 84578480
3,4-dimethoxy-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]benzamide
CID 2988177
N-[2-(5-methyl-1H-indol-3-yl)ethyl]-4-nitrobenzamide
CID 2038867
N-[2-(1H-indol-3-yl)ethyl]-2-(2-methoxyphenyl)acetamide
CID 4796568
1-(2,5-dimethoxyphenyl)-3-[2-(5-methyl-1H-indol-3-yl)ethyl]thiourea
CID 17272233
N-[2-(1H-indol-3-yl)ethyl]-4-(2-methoxy-5-methylphenyl)-4-oxobutanamide
CID 18107803

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide?
The IUPAC name of 2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide (CID 17271734) is 2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide?
The canonical SMILES for 2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide is COc1cccc(OC)c1C(=O)NCCc1c[nH]c2ccc(C)cc12.
What is the InChIKey of 2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide?
The InChIKey is QGIHLSHKPKKLNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-13-7-8-16-15(11-13)14(12-22-16)9-10-21-20(23)19-17(24-2)5-4-6-18(19)25-3/h4-8,11-12,22H,9-10H2,1-3H3,(H,21,23).
What are the key properties of 2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide?
2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide has a molecular weight of 338.41 g/mol, XLogP of 3.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-[2-(5-methyl-1H-indol-3-yl)ethyl]benzamide is sourced from PubChem (CID 17271734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).