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

C19H21N3O2 — CID 71701248

IUPAC1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide
SMILESCOCCn1ccc2c(C(=O)NCCc3ccccn3)cccc21
InChIInChI=1S/C19H21N3O2/c1-24-14-13-22-12-9-16-17(6-4-7-18(16)22)19(23)21-11-8-15-5-2-3-10-20-15/h2-7,9-10,12H,8,11,13-14H2,1H3,(H,21,23)
InChIKeyAGXHZOCCGMXSCF-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.66
Rot. Bonds7

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

1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide (PubChem CID 71701248) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide
PubChem CID71701248
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide
SMILESCOCCn1ccc2c(C(=O)NCCc3ccccn3)cccc21
InChIInChI=1S/C19H21N3O2/c1-24-14-13-22-12-9-16-17(6-4-7-18(16)22)19(23)21-11-8-15-5-2-3-10-20-15/h2-7,9-10,12H,8,11,13-14H2,1H3,(H,21,23)
InChIKeyAGXHZOCCGMXSCF-UHFFFAOYSA-N
XLogP2.66
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide?
The IUPAC name of 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide (CID 71701248) is 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide.
What is the SMILES notation for 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide?
The canonical SMILES for 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide is COCCn1ccc2c(C(=O)NCCc3ccccn3)cccc21.
What is the InChIKey of 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide?
The InChIKey is AGXHZOCCGMXSCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-24-14-13-22-12-9-16-17(6-4-7-18(16)22)19(23)21-11-8-15-5-2-3-10-20-15/h2-7,9-10,12H,8,11,13-14H2,1H3,(H,21,23).
What are the key properties of 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide?
1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide has a molecular weight of 323.40 g/mol, XLogP of 2.66, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide is sourced from PubChem (CID 71701248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).