1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide

C17H17N3O2 — CID 71701698

IUPAC1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide
SMILESCOCCn1cc(C(=O)Nc2cccnc2)c2ccccc21
InChIInChI=1S/C17H17N3O2/c1-22-10-9-20-12-15(14-6-2-3-7-16(14)20)17(21)19-13-5-4-8-18-11-13/h2-8,11-12H,9-10H2,1H3,(H,19,21)
InChIKeyCPNMMRGPGNFWIA-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.93
Rot. Bonds5

About 1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide

1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide (PubChem CID 71701698) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide
PubChem CID71701698
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide
SMILESCOCCn1cc(C(=O)Nc2cccnc2)c2ccccc21
InChIInChI=1S/C17H17N3O2/c1-22-10-9-20-12-15(14-6-2-3-7-16(14)20)17(21)19-13-5-4-8-18-11-13/h2-8,11-12H,9-10H2,1H3,(H,19,21)
InChIKeyCPNMMRGPGNFWIA-UHFFFAOYSA-N
XLogP2.93
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyethyl)-N-(4-oxo-1H-pyridin-3-yl)indole-3-carboxamide
CID 71883345
1-(2-methoxyethyl)-N-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]indole-3-carboxamide
CID 146102064
1-[[2-fluoro-4-(1-methylpyrazol-4-yl)phenyl]methyl]-N-pyridin-3-ylindole-3-carboxamide
CID 71656354
1-propyl-N-(4-pyridin-3-yloxyphenyl)indole-3-carboxamide;2,2,2-trifluoroacetic acid
CID 53385071
1-(2-methoxyethyl)-N-(2-oxochromen-6-yl)indole-3-carboxamide
CID 51125764
1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide
CID 71704949
1-(2-methoxyethyl)-N-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)indole-3-carboxamide
CID 71709068
1-(2-methoxyethyl)-N-[(3-methoxyphenyl)methyl]indole-3-carboxamide
CID 47072758
1-methyl-N-phenylindole-3-carboxamide
CID 9038340
3-[[1-(2-methoxyethyl)indole-3-carbonyl]amino]-2-methyl-2-phenylpropanoic acid
CID 120701315
6-[[1-(2-methoxyethyl)indole-3-carbonyl]amino]hexanoic acid
CID 119219776
2-[(2-methoxyacetyl)amino]-N-pyridin-3-ylbenzamide
CID 30337604

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide?
The IUPAC name of 1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide (CID 71701698) is 1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide.
What is the SMILES notation for 1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide?
The canonical SMILES for 1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide is COCCn1cc(C(=O)Nc2cccnc2)c2ccccc21.
What is the InChIKey of 1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide?
The InChIKey is CPNMMRGPGNFWIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-22-10-9-20-12-15(14-6-2-3-7-16(14)20)17(21)19-13-5-4-8-18-11-13/h2-8,11-12H,9-10H2,1H3,(H,19,21).
What are the key properties of 1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide?
1-(2-methoxyethyl)-N-pyridin-3-ylindole-3-carboxamide has a molecular weight of 295.34 g/mol, XLogP of 2.93, 5 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-3-ylindole-3-carboxamide is sourced from PubChem (CID 71701698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).