1-piperidin-4-yloxypyrrolo[2,3-b]pyridine

C12H15N3O — CID 71112397

IUPAC1-piperidin-4-yloxypyrrolo[2,3-b]pyridine
SMILESc1cnc2c(c1)ccn2OC1CCNCC1
InChIInChI=1S/C12H15N3O/c1-2-10-5-9-15(12(10)14-6-1)16-11-3-7-13-8-4-11/h1-2,5-6,9,11,13H,3-4,7-8H2
InChIKeyFUURAANAYZHWEO-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.22
Rot. Bonds2

About 1-piperidin-4-yloxypyrrolo[2,3-b]pyridine

1-piperidin-4-yloxypyrrolo[2,3-b]pyridine (PubChem CID 71112397) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 1-piperidin-4-yloxypyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name1-piperidin-4-yloxypyrrolo[2,3-b]pyridine
PubChem CID71112397
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name1-piperidin-4-yloxypyrrolo[2,3-b]pyridine
SMILESc1cnc2c(c1)ccn2OC1CCNCC1
InChIInChI=1S/C12H15N3O/c1-2-10-5-9-15(12(10)14-6-1)16-11-3-7-13-8-4-11/h1-2,5-6,9,11,13H,3-4,7-8H2
InChIKeyFUURAANAYZHWEO-UHFFFAOYSA-N
XLogP1.22
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane
CID 139110626
2-piperidin-4-yloxypyrimidine
CID 3836732
7-bromo-8-piperidin-4-yloxyquinoline
CID 68754211
1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine
CID 76852301
trimethyl(2-pyrrolo[2,3-b]pyridin-1-yloxyethyl)silane
CID 153406221
6-(azepan-4-yloxy)quinoline
CID 117051458
2-bromo-1-(pyrrolidin-3-ylmethyl)pyrrolo[2,3-b]pyridine
CID 117223880
1,8-naphthyridine;piperazine
CID 157389388
methane;1-methylpyrrolo[2,3-b]pyridine
CID 142434166
ethane;2-piperidin-4-yloxypyridine
CID 142889945
2-(piperidin-4-ylmethoxy)-1H-imidazo[4,5-b]pyridine;hydrochloride
CID 71636966
1-methyl-3-piperidin-4-ylpyrazolo[3,4-b]pyridine
CID 66509747

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-4-yloxypyrrolo[2,3-b]pyridine?
The IUPAC name of 1-piperidin-4-yloxypyrrolo[2,3-b]pyridine (CID 71112397) is 1-piperidin-4-yloxypyrrolo[2,3-b]pyridine.
What is the SMILES notation for 1-piperidin-4-yloxypyrrolo[2,3-b]pyridine?
The canonical SMILES for 1-piperidin-4-yloxypyrrolo[2,3-b]pyridine is c1cnc2c(c1)ccn2OC1CCNCC1.
What is the InChIKey of 1-piperidin-4-yloxypyrrolo[2,3-b]pyridine?
The InChIKey is FUURAANAYZHWEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-2-10-5-9-15(12(10)14-6-1)16-11-3-7-13-8-4-11/h1-2,5-6,9,11,13H,3-4,7-8H2.
What are the key properties of 1-piperidin-4-yloxypyrrolo[2,3-b]pyridine?
1-piperidin-4-yloxypyrrolo[2,3-b]pyridine has a molecular weight of 217.27 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-4-yloxypyrrolo[2,3-b]pyridine is sourced from PubChem (CID 71112397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).