1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide

C18H19N3O2 — CID 71707694

IUPAC1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide
SMILESCOCCn1ccc2c(C(=O)NCc3ccccn3)cccc21
InChIInChI=1S/C18H19N3O2/c1-23-12-11-21-10-8-15-16(6-4-7-17(15)21)18(22)20-13-14-5-2-3-9-19-14/h2-10H,11-13H2,1H3,(H,20,22)
InChIKeyJYLBVZKRMMQUCN-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.61
Rot. Bonds6

About 1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide

1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide (PubChem CID 71707694) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide
PubChem CID71707694
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide
SMILESCOCCn1ccc2c(C(=O)NCc3ccccn3)cccc21
InChIInChI=1S/C18H19N3O2/c1-23-12-11-21-10-8-15-16(6-4-7-17(15)21)18(22)20-13-14-5-2-3-9-19-14/h2-10H,11-13H2,1H3,(H,20,22)
InChIKeyJYLBVZKRMMQUCN-UHFFFAOYSA-N
XLogP2.61
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide
CID 71701248
1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide
CID 71704949
3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide
CID 71701153
N-(3-acetamidophenyl)-1-(2-methoxyethyl)indole-4-carboxamide
CID 71702506
1-(2-methoxyethyl)-4-pyridin-2-ylindole
CID 141303499
1-(2-methoxyethyl)-N-[[(2R)-oxolan-2-yl]methyl]indole-4-carboxamide
CID 96557798
methyl 2-[[1-(2-methoxyethyl)indole-4-carbonyl]amino]-5-methyl-1,3-thiazole-4-carboxylate
CID 71701299
1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide
CID 42667450
N-(pyridin-2-ylmethyl)-2-pyrrol-1-ylbenzamide
CID 39047420
1-(2-methoxyethyl)-N-[(1R)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]indole-4-carboxamide
CID 97264554
1,3-dimethyl-2,4-dioxo-N-(pyridin-2-ylmethyl)pyrimidine-5-carboxamide
CID 84557714
4-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)piperazine-1-carboxamide
CID 113104916

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide?
The IUPAC name of 1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide (CID 71707694) is 1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide.
What is the SMILES notation for 1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide?
The canonical SMILES for 1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide is COCCn1ccc2c(C(=O)NCc3ccccn3)cccc21.
What is the InChIKey of 1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide?
The InChIKey is JYLBVZKRMMQUCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-23-12-11-21-10-8-15-16(6-4-7-17(15)21)18(22)20-13-14-5-2-3-9-19-14/h2-10H,11-13H2,1H3,(H,20,22).
What are the key properties of 1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide?
1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide is sourced from PubChem (CID 71707694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).