piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone

C13H15N3O — CID 84692750

IUPACpiperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone
SMILESO=C(c1c[nH]c2cnccc12)C1CCCNC1
InChIInChI=1S/C13H15N3O/c17-13(9-2-1-4-14-6-9)11-7-16-12-8-15-5-3-10(11)12/h3,5,7-9,14,16H,1-2,4,6H2
InChIKeyLBVQTHRJFNFYQM-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.75
Rot. Bonds2

About piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone

piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone (PubChem CID 84692750) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone.

Molecular Properties

Compound Namepiperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone
PubChem CID84692750
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Namepiperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone
SMILESO=C(c1c[nH]c2cnccc12)C1CCCNC1
InChIInChI=1S/C13H15N3O/c17-13(9-2-1-4-14-6-9)11-7-16-12-8-15-5-3-10(11)12/h3,5,7-9,14,16H,1-2,4,6H2
InChIKeyLBVQTHRJFNFYQM-UHFFFAOYSA-N
XLogP1.75
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

piperidin-3-yl(1H-pyrrolo[3,2-b]pyridin-3-yl)methanone
CID 84692756
cyclohexyl(1H-pyrrolo[3,2-c]pyridin-3-yl)methanone
CID 102626384
(6-fluoro-1H-indol-3-yl)-pyrrolidin-3-ylmethanone
CID 84695539
(4-bromo-1H-indol-3-yl)-piperidin-3-ylmethanone
CID 115351659
piperidin-3-yl(pyridin-3-yl)methanone;dihydrochloride
CID 73012650
piperidin-3-yl(quinolin-5-yl)methanone
CID 116548060
(4-nitro-1H-indol-3-yl)-piperidin-3-ylmethanone
CID 64813461
cyclopentyl(1H-indol-3-yl)methanone
CID 14069740
oxolan-3-yl(1H-pyrrolo[3,2-c]pyridin-3-yl)methanone
CID 102626691
N-isoquinolin-5-ylpiperidine-3-carboxamide
CID 43702210
piperidine-3-carboxylic acid;(3R)-piperidine-3-carboxylic acid;pyrazine-2-carboxylic acid
CID 159112921
cyclopropyl(1H-indol-3-yl)methanone
CID 965839

Frequently Asked Questions

What is the IUPAC name of piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone?
The IUPAC name of piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone (CID 84692750) is piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone.
What is the SMILES notation for piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone?
The canonical SMILES for piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone is O=C(c1c[nH]c2cnccc12)C1CCCNC1.
What is the InChIKey of piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone?
The InChIKey is LBVQTHRJFNFYQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c17-13(9-2-1-4-14-6-9)11-7-16-12-8-15-5-3-10(11)12/h3,5,7-9,14,16H,1-2,4,6H2.
What are the key properties of piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone?
piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone has a molecular weight of 229.28 g/mol, XLogP of 1.75, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-3-yl(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone is sourced from PubChem (CID 84692750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).