(6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone

C14H16N2O3 — CID 70013039

IUPAC(6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone
SMILESO=C(c1cc2ccc(O)cc2[nH]1)N1CCC(O)CC1
InChIInChI=1S/C14H16N2O3/c17-10-3-5-16(6-4-10)14(19)13-7-9-1-2-11(18)8-12(9)15-13/h1-2,7-8,10,15,17-18H,3-6H2
InChIKeyFIOUXBHQHYRCAJ-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.47
Rot. Bonds1

About (6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone

(6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone (PubChem CID 70013039) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is (6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name(6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone
PubChem CID70013039
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name(6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone
SMILESO=C(c1cc2ccc(O)cc2[nH]1)N1CCC(O)CC1
InChIInChI=1S/C14H16N2O3/c17-10-3-5-16(6-4-10)14(19)13-7-9-1-2-11(18)8-12(9)15-13/h1-2,7-8,10,15,17-18H,3-6H2
InChIKeyFIOUXBHQHYRCAJ-UHFFFAOYSA-N
XLogP1.47
TPSA76.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone with MolForge

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Related Compounds

tert-butyl 4-(6-hydroxy-1H-indole-2-carbonyl)piperazine-1-carboxylate
CID 164936659
(3,5-dimethylmorpholin-4-yl)-(6-hydroxy-1H-indol-2-yl)methanone
CID 167983389
[2-(4-hydroxypiperidine-1-carbonyl)-1H-indol-5-yl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 68680973
(6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone
CID 110888104
(5-bromo-1H-indol-2-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 111562101
1-(6-bromo-1H-indole-2-carbonyl)-N,N-dimethylpiperidine-4-carboxamide
CID 134062050
(6-methoxy-1H-indol-2-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 4909282
(4-imidazol-1-ylpiperidin-1-yl)-(6-methyl-1H-indol-2-yl)methanone
CID 51107649
1-[2-(pyrrolidine-1-carbonyl)-1H-indol-6-yl]ethanone
CID 166245873
(6-hydroxy-1H-indol-2-yl)-[3-[(3,4,5-trimethoxyphenyl)methyl]piperidin-1-yl]methanone
CID 139988539
1H-indol-2-yl(morpholin-4-yl)methanone
CID 825286
N-cyclooctyl-6-hydroxy-1H-indole-2-carboxamide
CID 171355249

Frequently Asked Questions

What is the IUPAC name of (6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone?
The IUPAC name of (6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone (CID 70013039) is (6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone.
What is the SMILES notation for (6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone?
The canonical SMILES for (6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone is O=C(c1cc2ccc(O)cc2[nH]1)N1CCC(O)CC1.
What is the InChIKey of (6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone?
The InChIKey is FIOUXBHQHYRCAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c17-10-3-5-16(6-4-10)14(19)13-7-9-1-2-11(18)8-12(9)15-13/h1-2,7-8,10,15,17-18H,3-6H2.
What are the key properties of (6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone?
(6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone has a molecular weight of 260.29 g/mol, XLogP of 1.47, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone is sourced from PubChem (CID 70013039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).