2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone

C15H19NO2 — CID 112531224

IUPAC2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone
SMILESO=C(C1Cc2ccccc2C1)N1CCC(O)CC1
InChIInChI=1S/C15H19NO2/c17-14-5-7-16(8-6-14)15(18)13-9-11-3-1-2-4-12(11)10-13/h1-4,13-14,17H,5-10H2
InChIKeyNLUPCENKIYAREP-UHFFFAOYSA-N
MW245.32 g/mol
LogP1.38
Rot. Bonds1

About 2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone

2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone (PubChem CID 112531224) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone
PubChem CID112531224
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone
SMILESO=C(C1Cc2ccccc2C1)N1CCC(O)CC1
InChIInChI=1S/C15H19NO2/c17-14-5-7-16(8-6-14)15(18)13-9-11-3-1-2-4-12(11)10-13/h1-4,13-14,17H,5-10H2
InChIKeyNLUPCENKIYAREP-UHFFFAOYSA-N
XLogP1.38
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone?
The IUPAC name of 2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone (CID 112531224) is 2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone?
The canonical SMILES for 2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone is O=C(C1Cc2ccccc2C1)N1CCC(O)CC1.
What is the InChIKey of 2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone?
The InChIKey is NLUPCENKIYAREP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c17-14-5-7-16(8-6-14)15(18)13-9-11-3-1-2-4-12(11)10-13/h1-4,13-14,17H,5-10H2.
What are the key properties of 2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone?
2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone has a molecular weight of 245.32 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone is sourced from PubChem (CID 112531224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).