6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide

C18H19N3O2 — CID 113206552

IUPAC6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide
SMILESCOc1ccc2c(C(=O)N(C)CCc3ccncc3)c[nH]c2c1
InChIInChI=1S/C18H19N3O2/c1-21(10-7-13-5-8-19-9-6-13)18(22)16-12-20-17-11-14(23-2)3-4-15(16)17/h3-6,8-9,11-12,20H,7,10H2,1-2H3
InChIKeyLCWQBSXVODRDOA-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.89
Rot. Bonds5

About 6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide

6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide (PubChem CID 113206552) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is 6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide
PubChem CID113206552
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide
SMILESCOc1ccc2c(C(=O)N(C)CCc3ccncc3)c[nH]c2c1
InChIInChI=1S/C18H19N3O2/c1-21(10-7-13-5-8-19-9-6-13)18(22)16-12-20-17-11-14(23-2)3-4-15(16)17/h3-6,8-9,11-12,20H,7,10H2,1-2H3
InChIKeyLCWQBSXVODRDOA-UHFFFAOYSA-N
XLogP2.89
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,5,6-trimethoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide
CID 113206750
1-(5-methoxy-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)cyclopropane-1-carboxamide
CID 113210773
6-amino-N-methyl-N-(pyridin-4-ylmethyl)-1H-indole-3-carboxamide
CID 61095235
4-(3-methoxyphenyl)-N-methyl-N-(2-pyridin-4-ylethyl)benzamide
CID 77093047
5-chloro-2-methoxy-N,3-dimethyl-N-(2-pyridin-4-ylethyl)benzamide
CID 110762978
4-methoxy-N,2,5-trimethyl-N-(2-pyridin-4-ylethyl)benzamide
CID 110761596
N-benzyl-N-ethyl-6-methoxy-1H-indole-3-carboxamide
CID 113206541
6-methoxy-N-[(4-methoxyphenyl)methyl]-1H-indole-3-carboxamide
CID 113206539
2-(6-fluoro-1H-indol-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 113209385
6-(3-methoxyanilino)-N-methyl-N-(2-pyridin-4-ylethyl)pyridazine-3-carboxamide
CID 109122715
5-(2,5-dimethoxyanilino)-N-methyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 109237038
6-[2-(4-methoxyphenyl)ethylamino]-N-methyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 109158980

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide?
The IUPAC name of 6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide (CID 113206552) is 6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide.
What is the SMILES notation for 6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide?
The canonical SMILES for 6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide is COc1ccc2c(C(=O)N(C)CCc3ccncc3)c[nH]c2c1.
What is the InChIKey of 6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide?
The InChIKey is LCWQBSXVODRDOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-21(10-7-13-5-8-19-9-6-13)18(22)16-12-20-17-11-14(23-2)3-4-15(16)17/h3-6,8-9,11-12,20H,7,10H2,1-2H3.
What are the key properties of 6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide?
6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)-1H-indole-3-carboxamide is sourced from PubChem (CID 113206552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).