2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide

C18H19N3O2 — CID 2572661

IUPAC2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C18H19N3O2/c1-2-23-18-15(7-5-10-20-18)17(22)19-11-9-13-12-21-16-8-4-3-6-14(13)16/h3-8,10,12,21H,2,9,11H2,1H3,(H,19,22)
InChIKeyIPCNOCRVRHYBLH-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.93
Rot. Bonds6

About 2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide

2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide (PubChem CID 2572661) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide
PubChem CID2572661
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C18H19N3O2/c1-2-23-18-15(7-5-10-20-18)17(22)19-11-9-13-12-21-16-8-4-3-6-14(13)16/h3-8,10,12,21H,2,9,11H2,1H3,(H,19,22)
InChIKeyIPCNOCRVRHYBLH-UHFFFAOYSA-N
XLogP2.93
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide (CID 2572661) is 2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide is CCOc1ncccc1C(=O)NCCc1c[nH]c2ccccc12.
What is the InChIKey of 2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide?
The InChIKey is IPCNOCRVRHYBLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-2-23-18-15(7-5-10-20-18)17(22)19-11-9-13-12-21-16-8-4-3-6-14(13)16/h3-8,10,12,21H,2,9,11H2,1H3,(H,19,22).
What are the key properties of 2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide?
2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 2.93, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 2572661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).