3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide

C20H23N3O2 — CID 71701153

IUPAC3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide
SMILESCOCCn1cc(CCC(=O)NCc2ccccn2)c2ccccc21
InChIInChI=1S/C20H23N3O2/c1-25-13-12-23-15-16(18-7-2-3-8-19(18)23)9-10-20(24)22-14-17-6-4-5-11-21-17/h2-8,11,15H,9-10,12-14H2,1H3,(H,22,24)
InChIKeyBWDDYPKGDGWTMZ-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.93
Rot. Bonds8

About 3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide

3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide (PubChem CID 71701153) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide.

Molecular Properties

Compound Name3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide
PubChem CID71701153
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide
SMILESCOCCn1cc(CCC(=O)NCc2ccccn2)c2ccccc21
InChIInChI=1S/C20H23N3O2/c1-25-13-12-23-15-16(18-7-2-3-8-19(18)23)9-10-20(24)22-14-17-6-4-5-11-21-17/h2-8,11,15H,9-10,12-14H2,1H3,(H,22,24)
InChIKeyBWDDYPKGDGWTMZ-UHFFFAOYSA-N
XLogP2.93
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[1-[(2-methylphenyl)methyl]indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide
CID 20900008
1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide
CID 71704949
1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide
CID 71707694
3-(1-methylindol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
CID 71702593
4-[1-(2-methoxyethyl)indol-3-yl]butanoic acid
CID 43246925
N-[[1-(2-pyridin-2-ylethyl)indol-3-yl]methyl]ethanamine
CID 66409305
1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide
CID 71701248
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-3-[1-(2-methoxyethyl)indol-3-yl]propanamide
CID 71706857
3-(1,5-dimethylpyrazol-4-yl)-N-(pyridin-2-ylmethyl)propanamide
CID 35762699
3-[1-[(2-fluorophenyl)methyl]indol-3-yl]-N-(2-methoxyethyl)propanamide
CID 20899972
2-[1-(2-ethoxyethyl)-5-quinolin-6-ylindol-3-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 171476870
3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide
CID 898315

Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide?
The IUPAC name of 3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide (CID 71701153) is 3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide.
What is the SMILES notation for 3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide?
The canonical SMILES for 3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide is COCCn1cc(CCC(=O)NCc2ccccn2)c2ccccc21.
What is the InChIKey of 3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide?
The InChIKey is BWDDYPKGDGWTMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-25-13-12-23-15-16(18-7-2-3-8-19(18)23)9-10-20(24)22-14-17-6-4-5-11-21-17/h2-8,11,15H,9-10,12-14H2,1H3,(H,22,24).
What are the key properties of 3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide?
3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide has a molecular weight of 337.42 g/mol, XLogP of 2.93, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide is sourced from PubChem (CID 71701153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).