2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol

C27H35N5O2 — CID 138688584

IUPAC2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol
SMILESCc1cc(-c2[nH]c3ccc(OC4CCN(CC(C)(C)O)CC4)cc3c2C(C)C)cn2ncnc12
InChIInChI=1S/C27H35N5O2/c1-17(2)24-22-13-21(34-20-8-10-31(11-9-20)15-27(4,5)33)6-7-23(22)30-25(24)19-12-18(3)26-28-16-29-32(26)14-19/h6-7,12-14,16-17,20,30,33H,8-11,15H2,1-5H3
InChIKeyNBAMGRWSUDGMAC-UHFFFAOYSA-N
MW461.61 g/mol
LogP4.92
Rot. Bonds6

About 2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol

2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol (PubChem CID 138688584) has the molecular formula C27H35N5O2 and a molecular weight of 461.61 g/mol. Its IUPAC name is 2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol
PubChem CID138688584
Molecular FormulaC27H35N5O2
Molecular Weight461.61 g/mol
Exact Mass461.28
IUPAC Name2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol
SMILESCc1cc(-c2[nH]c3ccc(OC4CCN(CC(C)(C)O)CC4)cc3c2C(C)C)cn2ncnc12
InChIInChI=1S/C27H35N5O2/c1-17(2)24-22-13-21(34-20-8-10-31(11-9-20)15-27(4,5)33)6-7-23(22)30-25(24)19-12-18(3)26-28-16-29-32(26)14-19/h6-7,12-14,16-17,20,30,33H,8-11,15H2,1-5H3
InChIKeyNBAMGRWSUDGMAC-UHFFFAOYSA-N
XLogP4.92
TPSA78.68 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.61
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 3-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]propanoate
CID 161420317
2-[4-[[2-(1,5-dimethyl-6-oxo-3-pyridinyl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]-N-methylacetamide
CID 138688605
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
[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone
CID 150448803
2-tert-butyl-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 155142368
N-methyl-3-[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]propanamide
CID 159935197
6-(5-heptan-4-yl-3-propan-2-yl-1H-indol-2-yl)-8-methyl-[1,2,4]triazolo[1,5-a]pyridine;propanoic acid
CID 145431911
[6-[5-[1-(isocyanomethyl)piperidin-4-yl]-3-propan-2-yl-1H-indol-2-yl]-[1,2,4]triazolo[1,5-a]pyridin-8-yl]methanol
CID 140830350
(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
2-[4-[3-propan-2-yl-2-[8-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-1H-indol-5-yl]piperidin-1-yl]acetonitrile
CID 135319385
1-[4-[6-(7,8-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl]piperidin-1-yl]-2-methylpropan-2-ol
CID 154641049
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

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol?
The IUPAC name of 2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol (CID 138688584) is 2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol.
What is the SMILES notation for 2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol?
The canonical SMILES for 2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol is Cc1cc(-c2[nH]c3ccc(OC4CCN(CC(C)(C)O)CC4)cc3c2C(C)C)cn2ncnc12.
What is the InChIKey of 2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol?
The InChIKey is NBAMGRWSUDGMAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H35N5O2/c1-17(2)24-22-13-21(34-20-8-10-31(11-9-20)15-27(4,5)33)6-7-23(22)30-25(24)19-12-18(3)26-28-16-29-32(26)14-19/h6-7,12-14,16-17,20,30,33H,8-11,15H2,1-5H3.
What are the key properties of 2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol?
2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol has a molecular weight of 461.61 g/mol, XLogP of 4.92, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[4-[[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]oxy]piperidin-1-yl]propan-2-ol is sourced from PubChem (CID 138688584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).