N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide

C27H34N6O3 — CID 155154899

IUPACN-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide
SMILESCCN(C)C(=O)CN1CCOC(c2ccc3[nH]c(-c4cc(OC)c5ncnn5c4)c(C(C)C)c3c2)C1
InChIInChI=1S/C27H34N6O3/c1-6-31(4)24(34)15-32-9-10-36-23(14-32)18-7-8-21-20(11-18)25(17(2)3)26(30-21)19-12-22(35-5)27-28-16-29-33(27)13-19/h7-8,11-13,16-17,23,30H,6,9-10,14-15H2,1-5H3
InChIKeyCNUSPJKHYUSTBU-UHFFFAOYSA-N
MW490.61 g/mol
LogP3.86
Rot. Bonds7

About N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide

N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide (PubChem CID 155154899) has the molecular formula C27H34N6O3 and a molecular weight of 490.61 g/mol. Its IUPAC name is N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide.

Molecular Properties

Compound NameN-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide
PubChem CID155154899
Molecular FormulaC27H34N6O3
Molecular Weight490.61 g/mol
Exact Mass490.27
IUPAC NameN-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide
SMILESCCN(C)C(=O)CN1CCOC(c2ccc3[nH]c(-c4cc(OC)c5ncnn5c4)c(C(C)C)c3c2)C1
InChIInChI=1S/C27H34N6O3/c1-6-31(4)24(34)15-32-9-10-36-23(14-32)18-7-8-21-20(11-18)25(17(2)3)26(30-21)19-12-22(35-5)27-28-16-29-33(27)13-19/h7-8,11-13,16-17,23,30H,6,9-10,14-15H2,1-5H3
InChIKeyCNUSPJKHYUSTBU-UHFFFAOYSA-N
XLogP3.86
TPSA87.99 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.61
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide with MolForge

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Related Compounds

2-[ethyl(methyl)amino]-1-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]ethanone
CID 155142294
1-[4-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]piperidin-1-yl]butan-2-one
CID 158399041
2-(dimethylamino)-1-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[3,2-b]pyridin-5-yl]morpholin-4-yl]ethanone
CID 138686971
8-methoxy-6-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine;dihydrochloride
CID 140830339
2-[cyclopropyl(methyl)amino]-N-[4-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]acetamide
CID 154639602
3-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]-N-methyl-N-(2-methylsulfonylethyl)cyclobutan-1-amine
CID 154639556
8-methoxy-6-[3-propan-2-yl-5-(1-propan-2-ylpiperidin-3-yl)-1H-indol-2-yl]-[1,2,4]triazolo[1,5-a]pyridine
CID 154639581
N-[3-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclobutyl]oxetan-3-amine
CID 154639635
2-[4-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperazin-1-yl]-N-methylacetamide
CID 155226142
(2R)-4,5,5-trimethyl-2-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholine
CID 175793393
3-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]azetidine-1-carboxylic acid
CID 155142382
2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide
CID 155226197

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide?
The IUPAC name of N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide (CID 155154899) is N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide.
What is the SMILES notation for N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide?
The canonical SMILES for N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide is CCN(C)C(=O)CN1CCOC(c2ccc3[nH]c(-c4cc(OC)c5ncnn5c4)c(C(C)C)c3c2)C1.
What is the InChIKey of N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide?
The InChIKey is CNUSPJKHYUSTBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H34N6O3/c1-6-31(4)24(34)15-32-9-10-36-23(14-32)18-7-8-21-20(11-18)25(17(2)3)26(30-21)19-12-22(35-5)27-28-16-29-33(27)13-19/h7-8,11-13,16-17,23,30H,6,9-10,14-15H2,1-5H3.
What are the key properties of N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide?
N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide has a molecular weight of 490.61 g/mol, XLogP of 3.86, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[2-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]morpholin-4-yl]-N-methylacetamide is sourced from PubChem (CID 155154899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).