(6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone

C14H15ClN2O2 — CID 110888104

IUPAC(6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone
SMILESO=C(c1cc2ccc(Cl)cc2[nH]1)N1CCCC(O)C1
InChIInChI=1S/C14H15ClN2O2/c15-10-4-3-9-6-13(16-12(9)7-10)14(19)17-5-1-2-11(18)8-17/h3-4,6-7,11,16,18H,1-2,5,8H2
InChIKeyQWPUJLZPQRSWIU-UHFFFAOYSA-N
MW278.74 g/mol
LogP2.42
Rot. Bonds1

About (6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone

(6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone (PubChem CID 110888104) has the molecular formula C14H15ClN2O2 and a molecular weight of 278.74 g/mol. Its IUPAC name is (6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name(6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone
PubChem CID110888104
Molecular FormulaC14H15ClN2O2
Molecular Weight278.74 g/mol
Exact Mass278.08
IUPAC Name(6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone
SMILESO=C(c1cc2ccc(Cl)cc2[nH]1)N1CCCC(O)C1
InChIInChI=1S/C14H15ClN2O2/c15-10-4-3-9-6-13(16-12(9)7-10)14(19)17-5-1-2-11(18)8-17/h3-4,6-7,11,16,18H,1-2,5,8H2
InChIKeyQWPUJLZPQRSWIU-UHFFFAOYSA-N
XLogP2.42
TPSA56.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(5-chloro-1H-indol-2-yl)-pyrrolidin-1-ylmethanone
CID 3661150
(2,5-dichlorophenyl)-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 93032488
(5-chloro-2-hydroxyphenyl)-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 93032502
(3R,4R)-1-(6-chloro-1H-indole-2-carbonyl)-4-cyclopropylpyrrolidine-3-carboxylic acid
CID 120978687
(7-amino-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone
CID 63117526
(2-amino-5-chlorophenyl)-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 107211689
(6-hydroxy-1H-indol-2-yl)-(4-hydroxypiperidin-1-yl)methanone
CID 70013039
(5-bromo-1H-indol-2-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 111562101
[3-[(3R)-3-hydroxypiperidine-1-carbonyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]-(1H-indol-2-yl)methanone
CID 142576753
[4-(6-chloro-1H-indole-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 38908871
(3-ethoxypiperidin-1-yl)-(6-methyl-1H-indol-2-yl)methanone
CID 56819947
(4,5-dichloro-1H-pyrrol-2-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 66260480

Frequently Asked Questions

What is the IUPAC name of (6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone?
The IUPAC name of (6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone (CID 110888104) is (6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone.
What is the SMILES notation for (6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone?
The canonical SMILES for (6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone is O=C(c1cc2ccc(Cl)cc2[nH]1)N1CCCC(O)C1.
What is the InChIKey of (6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone?
The InChIKey is QWPUJLZPQRSWIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2/c15-10-4-3-9-6-13(16-12(9)7-10)14(19)17-5-1-2-11(18)8-17/h3-4,6-7,11,16,18H,1-2,5,8H2.
What are the key properties of (6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone?
(6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone has a molecular weight of 278.74 g/mol, XLogP of 2.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-1H-indol-2-yl)-(3-hydroxypiperidin-1-yl)methanone is sourced from PubChem (CID 110888104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).