N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide

C20H22N4O3 — CID 84561960

IUPACN-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide
SMILESO=C(Nc1ccc(OCCN2CCOCC2)nc1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C20H22N4O3/c25-20(16-2-1-15-5-6-21-18(15)13-16)23-17-3-4-19(22-14-17)27-12-9-24-7-10-26-11-8-24/h1-6,13-14,21H,7-12H2,(H,23,25)
InChIKeyAPDMTXBMQHREAN-UHFFFAOYSA-N
MW366.42 g/mol
LogP2.53
Rot. Bonds6

About N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide

N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide (PubChem CID 84561960) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide
PubChem CID84561960
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC NameN-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide
SMILESO=C(Nc1ccc(OCCN2CCOCC2)nc1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C20H22N4O3/c25-20(16-2-1-15-5-6-21-18(15)13-16)23-17-3-4-19(22-14-17)27-12-9-24-7-10-26-11-8-24/h1-6,13-14,21H,7-12H2,(H,23,25)
InChIKeyAPDMTXBMQHREAN-UHFFFAOYSA-N
XLogP2.53
TPSA79.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide?
The IUPAC name of N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide (CID 84561960) is N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide.
What is the SMILES notation for N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide?
The canonical SMILES for N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide is O=C(Nc1ccc(OCCN2CCOCC2)nc1)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide?
The InChIKey is APDMTXBMQHREAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c25-20(16-2-1-15-5-6-21-18(15)13-16)23-17-3-4-19(22-14-17)27-12-9-24-7-10-26-11-8-24/h1-6,13-14,21H,7-12H2,(H,23,25).
What are the key properties of N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide?
N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide has a molecular weight of 366.42 g/mol, XLogP of 2.53, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide is sourced from PubChem (CID 84561960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).