1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide

C19H21N3O2 — CID 71704949

IUPAC1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide
SMILESCOCCn1cc(C(=O)NCCc2ccccn2)c2ccccc21
InChIInChI=1S/C19H21N3O2/c1-24-13-12-22-14-17(16-7-2-3-8-18(16)22)19(23)21-11-9-15-6-4-5-10-20-15/h2-8,10,14H,9,11-13H2,1H3,(H,21,23)
InChIKeyIHGCUTOXMPZFES-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.66
Rot. Bonds7

About 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide

1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide (PubChem CID 71704949) 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-3-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide
PubChem CID71704949
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide
SMILESCOCCn1cc(C(=O)NCCc2ccccn2)c2ccccc21
InChIInChI=1S/C19H21N3O2/c1-24-13-12-22-14-17(16-7-2-3-8-18(16)22)19(23)21-11-9-15-6-4-5-10-20-15/h2-8,10,14H,9,11-13H2,1H3,(H,21,23)
InChIKeyIHGCUTOXMPZFES-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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Related Compounds

1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-4-carboxamide
CID 71701248
1-methyl-N-(2-pyridin-2-ylethyl)indole-3-carboxamide
CID 29353033
1-benzyl-N-(2-pyridin-2-ylethyl)indole-3-carboxamide
CID 31941346
4-[[1-(2-methoxyethyl)indole-3-carbonyl]amino]butanoic acid
CID 119170603
1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide
CID 71707694
3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide
CID 71701153
6-[[1-(2-methoxyethyl)indole-3-carbonyl]amino]hexanoic acid
CID 119219776
N-[2-(4-tert-butyl-1,3-thiazol-2-yl)ethyl]-1-(2-methoxyethyl)indole-3-carboxamide
CID 71703519
2-(2-methylpropyl)-1-oxo-N-(2-pyridin-2-ylethyl)isoquinoline-4-carboxamide
CID 71700597
5-[[1-(pyridin-2-ylmethyl)indole-3-carbonyl]amino]pentanoic acid
CID 175130499
3-[[1-(2-methoxyethyl)indole-3-carbonyl]amino]-2-methyl-2-phenylpropanoic acid
CID 120701315
1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide
CID 71701698

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide?
The IUPAC name of 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide (CID 71704949) is 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide.
What is the SMILES notation for 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide?
The canonical SMILES for 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide is COCCn1cc(C(=O)NCCc2ccccn2)c2ccccc21.
What is the InChIKey of 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide?
The InChIKey is IHGCUTOXMPZFES-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-24-13-12-22-14-17(16-7-2-3-8-18(16)22)19(23)21-11-9-15-6-4-5-10-20-15/h2-8,10,14H,9,11-13H2,1H3,(H,21,23).
What are the key properties of 1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide?
1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-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-3-carboxamide is sourced from PubChem (CID 71704949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).