2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol

C16H23NO3 — CID 86814537

IUPAC2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol
SMILESOCCOC1CCCN(C2Cc3ccccc3C2O)C1
InChIInChI=1S/C16H23NO3/c18-8-9-20-13-5-3-7-17(11-13)15-10-12-4-1-2-6-14(12)16(15)19/h1-2,4,6,13,15-16,18-19H,3,5,7-11H2
InChIKeyHUNUDVAKSCQCDI-UHFFFAOYSA-N
MW277.36 g/mol
LogP1.12
Rot. Bonds4

About 2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol

2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol (PubChem CID 86814537) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is 2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol
PubChem CID86814537
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC Name2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol
SMILESOCCOC1CCCN(C2Cc3ccccc3C2O)C1
InChIInChI=1S/C16H23NO3/c18-8-9-20-13-5-3-7-17(11-13)15-10-12-4-1-2-6-14(12)16(15)19/h1-2,4,6,13,15-16,18-19H,3,5,7-11H2
InChIKeyHUNUDVAKSCQCDI-UHFFFAOYSA-N
XLogP1.12
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-ol
CID 63636093
2-(3-methoxypiperidin-1-yl)-2,3-dihydro-1H-inden-1-amine
CID 102965518
N-[1-(1-hydroxy-2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-methylpropanamide
CID 84598887
2-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,3-dihydro-1H-inden-1-ol
CID 79930431
2-(4,4-dimethylpiperidin-1-yl)-2,3-dihydro-1H-inden-1-ol
CID 62930073
2-(1-benzylpiperidin-3-yl)oxyethanol
CID 66563831
2-(3-ethyl-4-methylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-ol
CID 63634001
(2S)-2-morpholin-4-yl-2,3-dihydro-1H-inden-1-ol
CID 58393444
2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 102966127
6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ol
CID 65320050
2-(4-pyrimidin-2-yl-1,4-diazepan-1-yl)-2,3-dihydro-1H-inden-1-ol
CID 75444809
1-[(1S,2R)-1-hydroxy-2,3-dihydro-1H-inden-2-yl]-N-(3-methylbutyl)piperidine-4-carboxamide
CID 97335580

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol (CID 86814537) is 2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol is OCCOC1CCCN(C2Cc3ccccc3C2O)C1.
What is the InChIKey of 2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol?
The InChIKey is HUNUDVAKSCQCDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO3/c18-8-9-20-13-5-3-7-17(11-13)15-10-12-4-1-2-6-14(12)16(15)19/h1-2,4,6,13,15-16,18-19H,3,5,7-11H2.
What are the key properties of 2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol?
2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol has a molecular weight of 277.36 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-hydroxyethoxy)piperidin-1-yl]-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 86814537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).