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

C15H19NO2 — CID 112530917

IUPAC2,3-dihydro-1H-inden-2-yl-(3-hydroxypiperidin-1-yl)methanone
SMILESO=C(C1Cc2ccccc2C1)N1CCCC(O)C1
InChIInChI=1S/C15H19NO2/c17-14-6-3-7-16(10-14)15(18)13-8-11-4-1-2-5-12(11)9-13/h1-2,4-5,13-14,17H,3,6-10H2
InChIKeyKUUPETODOXCAEG-UHFFFAOYSA-N
MW245.32 g/mol
LogP1.38
Rot. Bonds1

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

2,3-dihydro-1H-inden-2-yl-(3-hydroxypiperidin-1-yl)methanone (PubChem CID 112530917) 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-(3-hydroxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-2-yl-(3-hydroxypiperidin-1-yl)methanone
PubChem CID112530917
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name2,3-dihydro-1H-inden-2-yl-(3-hydroxypiperidin-1-yl)methanone
SMILESO=C(C1Cc2ccccc2C1)N1CCCC(O)C1
InChIInChI=1S/C15H19NO2/c17-14-6-3-7-16(10-14)15(18)13-8-11-4-1-2-5-12(11)9-13/h1-2,4-5,13-14,17H,3,6-10H2
InChIKeyKUUPETODOXCAEG-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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Related Compounds

2,3-dihydro-1H-inden-2-yl-(4-hydroxypiperidin-1-yl)methanone
CID 112531224
2,3-dihydro-1H-inden-2-yl-[3-(1-hydroxycyclopropyl)piperidin-1-yl]methanone
CID 138381348
methyl 1-(2,3-dihydro-1H-indene-2-carbonyl)piperidine-3-carboxylate
CID 112531649
2,3-dihydro-1H-inden-2-yl-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 106703940
2,3-dihydro-1-benzothiophen-2-yl-(3-hydroxypiperidin-1-yl)methanone
CID 43415901
cyclopentyl-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 93040537
(3-hydroxypiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-2-yl)methanone
CID 61435167
3-(3-methylpiperidine-1-carbonyl)-3,4-dihydro-2H-naphthalen-1-one
CID 110677782
[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-pyrrolidin-1-ylmethanone
CID 3039575
[3-(methylamino)piperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
CID 107125909
cyclopropyl-[3-(3-hydroxypiperidine-1-carbonyl)piperidin-1-yl]methanone
CID 43502686
1-[3-(3-hydroxypiperidine-1-carbonyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-methylbutan-1-one
CID 111101958

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-2-yl-(3-hydroxypiperidin-1-yl)methanone?
The IUPAC name of 2,3-dihydro-1H-inden-2-yl-(3-hydroxypiperidin-1-yl)methanone (CID 112530917) is 2,3-dihydro-1H-inden-2-yl-(3-hydroxypiperidin-1-yl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-inden-2-yl-(3-hydroxypiperidin-1-yl)methanone?
The canonical SMILES for 2,3-dihydro-1H-inden-2-yl-(3-hydroxypiperidin-1-yl)methanone is O=C(C1Cc2ccccc2C1)N1CCCC(O)C1.
What is the InChIKey of 2,3-dihydro-1H-inden-2-yl-(3-hydroxypiperidin-1-yl)methanone?
The InChIKey is KUUPETODOXCAEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c17-14-6-3-7-16(10-14)15(18)13-8-11-4-1-2-5-12(11)9-13/h1-2,4-5,13-14,17H,3,6-10H2.
What are the key properties of 2,3-dihydro-1H-inden-2-yl-(3-hydroxypiperidin-1-yl)methanone?
2,3-dihydro-1H-inden-2-yl-(3-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-(3-hydroxypiperidin-1-yl)methanone is sourced from PubChem (CID 112530917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).