2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone

C21H25N3O2 — CID 133397709

IUPAC2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone
SMILESCC(O)C1CCCN(c2ncccc2C(=O)N2CCc3ccccc32)C1
InChIInChI=1S/C21H25N3O2/c1-15(25)17-7-5-12-23(14-17)20-18(8-4-11-22-20)21(26)24-13-10-16-6-2-3-9-19(16)24/h2-4,6,8-9,11,15,17,25H,5,7,10,12-14H2,1H3
InChIKeyQXGSUEAALMSBPT-UHFFFAOYSA-N
MW351.45 g/mol
LogP2.88
Rot. Bonds3

About 2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone

2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone (PubChem CID 133397709) has the molecular formula C21H25N3O2 and a molecular weight of 351.45 g/mol. Its IUPAC name is 2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone.

Molecular Properties

Compound Name2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone
PubChem CID133397709
Molecular FormulaC21H25N3O2
Molecular Weight351.45 g/mol
Exact Mass351.19
IUPAC Name2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone
SMILESCC(O)C1CCCN(c2ncccc2C(=O)N2CCc3ccccc32)C1
InChIInChI=1S/C21H25N3O2/c1-15(25)17-7-5-12-23(14-17)20-18(8-4-11-22-20)21(26)24-13-10-16-6-2-3-9-19(16)24/h2-4,6,8-9,11,15,17,25H,5,7,10,12-14H2,1H3
InChIKeyQXGSUEAALMSBPT-UHFFFAOYSA-N
XLogP2.88
TPSA56.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone 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

2-[3-(1-hydroxyethyl)piperidin-1-yl]-N-methylpyridine-3-carboxamide
CID 133397673
1-[3-(2,3-dihydroindole-1-carbonyl)-2-pyridinyl]-N-(5-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 133319017
2,3-dihydroindol-1-yl-(2-pyrrolidin-1-ylphenyl)methanone
CID 168513032
2,3-dihydroindol-1-yl-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methanone
CID 25466745
cyclopentyl-[3-[[3-(2,3-dihydroindole-1-carbonyl)-2-pyridinyl]amino]pyrrolidin-1-yl]methanone
CID 133366904
1-(1-pyrimidin-2-ylpiperidin-3-yl)ethanol
CID 133397978
[1-(3-chloro-2-pyridinyl)piperidin-4-yl]-(2,3-dihydroindol-1-yl)methanone
CID 172902388
2,3-dihydroindol-1-yl-[2-(propan-2-ylamino)phenyl]methanone
CID 63107611
(2-piperidin-1-yl-3-pyridinyl)-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)methanone
CID 55759909
(1R)-1-[(3S)-1-(3-chloropyrazin-2-yl)piperidin-3-yl]ethanol
CID 129495606
1-(2,3-dihydroindol-1-yl)-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-1-one
CID 110020014
(3-methylpiperidin-1-yl)-(2-piperidin-1-yl-3-pyridinyl)methanone
CID 84576155

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone?
The IUPAC name of 2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone (CID 133397709) is 2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone.
What is the SMILES notation for 2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone?
The canonical SMILES for 2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone is CC(O)C1CCCN(c2ncccc2C(=O)N2CCc3ccccc32)C1.
What is the InChIKey of 2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone?
The InChIKey is QXGSUEAALMSBPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O2/c1-15(25)17-7-5-12-23(14-17)20-18(8-4-11-22-20)21(26)24-13-10-16-6-2-3-9-19(16)24/h2-4,6,8-9,11,15,17,25H,5,7,10,12-14H2,1H3.
What are the key properties of 2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone?
2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone has a molecular weight of 351.45 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroindol-1-yl-[2-[3-(1-hydroxyethyl)piperidin-1-yl]-3-pyridinyl]methanone is sourced from PubChem (CID 133397709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).