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

C25H25N3O3 — CID 42667450

IUPAC1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide
SMILESCOCCn1c(C(=O)NCc2ccccn2)cc2c(OCc3ccccc3)cccc21
InChIInChI=1S/C25H25N3O3/c1-30-15-14-28-22-11-7-12-24(31-18-19-8-3-2-4-9-19)21(22)16-23(28)25(29)27-17-20-10-5-6-13-26-20/h2-13,16H,14-15,17-18H2,1H3,(H,27,29)
InChIKeyQORGBSZLWPQWMS-UHFFFAOYSA-N
MW415.49 g/mol
LogP4.19
Rot. Bonds9

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

1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide (PubChem CID 42667450) has the molecular formula C25H25N3O3 and a molecular weight of 415.49 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide
PubChem CID42667450
Molecular FormulaC25H25N3O3
Molecular Weight415.49 g/mol
Exact Mass415.19
IUPAC Name1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide
SMILESCOCCn1c(C(=O)NCc2ccccn2)cc2c(OCc3ccccc3)cccc21
InChIInChI=1S/C25H25N3O3/c1-30-15-14-28-22-11-7-12-24(31-18-19-8-3-2-4-9-19)21(22)16-23(28)25(29)27-17-20-10-5-6-13-26-20/h2-13,16H,14-15,17-18H2,1H3,(H,27,29)
InChIKeyQORGBSZLWPQWMS-UHFFFAOYSA-N
XLogP4.19
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.49
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-benzyl-N-hexyl-4-phenylmethoxyindole-2-carboxamide
CID 42804017
1-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)indole-4-carboxamide
CID 71707694
1-(2-methoxyethyl)-N-(pyridin-3-ylmethyl)indole-2-carboxamide
CID 71700512
N-cyclopropyl-1-(2-methylpropyl)-4-phenylmethoxyindole-2-carboxamide
CID 42807240
1,5-dimethyl-4-oxo-N-(pyridin-2-ylmethyl)pyrrolo[3,2-c]quinoline-2-carboxamide
CID 5309438
2-(methoxymethyl)-6-methyl-4-oxo-1-(3-phenylpropyl)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 26344453
[4-[[[1-[(3-carbamimidoylphenyl)methyl]-4-phenylmethoxyindole-2-carbonyl]amino]methyl]phenyl]-trimethylazanium;iodide;hydroiodide
CID 18327665
4-prop-2-enoxy-N-(2-pyridin-2-ylethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indole-2-carboxamide
CID 42667040
3-[1-(2-methoxyethyl)indol-3-yl]-N-(pyridin-2-ylmethyl)propanamide
CID 71701153
(4-methylpiperidin-1-yl)-(4-phenylmethoxy-1-propylindol-2-yl)methanone
CID 42666955
4-bromo-1-methyl-N-(pyridin-2-ylmethyl)pyrrole-2-carboxamide
CID 43411105
4-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)piperazine-1-carboxamide
CID 113104916

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide?
The IUPAC name of 1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide (CID 42667450) is 1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide.
What is the SMILES notation for 1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide?
The canonical SMILES for 1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide is COCCn1c(C(=O)NCc2ccccn2)cc2c(OCc3ccccc3)cccc21.
What is the InChIKey of 1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide?
The InChIKey is QORGBSZLWPQWMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O3/c1-30-15-14-28-22-11-7-12-24(31-18-19-8-3-2-4-9-19)21(22)16-23(28)25(29)27-17-20-10-5-6-13-26-20/h2-13,16H,14-15,17-18H2,1H3,(H,27,29).
What are the key properties of 1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide?
1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide has a molecular weight of 415.49 g/mol, XLogP of 4.19, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-4-phenylmethoxy-N-(pyridin-2-ylmethyl)indole-2-carboxamide is sourced from PubChem (CID 42667450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).