6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine

C19H21N3O — CID 56909493

IUPAC6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESCOC1(c2ccccc2)CCN(c2ccc3cc[nH]c3n2)CC1
InChIInChI=1S/C19H21N3O/c1-23-19(16-5-3-2-4-6-16)10-13-22(14-11-19)17-8-7-15-9-12-20-18(15)21-17/h2-9,12H,10-11,13-14H2,1H3,(H,20,21)
InChIKeySYUDFJGVAMYJLZ-UHFFFAOYSA-N
MW307.40 g/mol
LogP3.70
Rot. Bonds3

About 6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine

6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine (PubChem CID 56909493) has the molecular formula C19H21N3O and a molecular weight of 307.40 g/mol. Its IUPAC name is 6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine
PubChem CID56909493
Molecular FormulaC19H21N3O
Molecular Weight307.40 g/mol
Exact Mass307.17
IUPAC Name6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESCOC1(c2ccccc2)CCN(c2ccc3cc[nH]c3n2)CC1
InChIInChI=1S/C19H21N3O/c1-23-19(16-5-3-2-4-6-16)10-13-22(14-11-19)17-8-7-15-9-12-20-18(15)21-17/h2-9,12H,10-11,13-14H2,1H3,(H,20,21)
InChIKeySYUDFJGVAMYJLZ-UHFFFAOYSA-N
XLogP3.70
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine (CID 56909493) is 6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine is COC1(c2ccccc2)CCN(c2ccc3cc[nH]c3n2)CC1.
What is the InChIKey of 6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is SYUDFJGVAMYJLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O/c1-23-19(16-5-3-2-4-6-16)10-13-22(14-11-19)17-8-7-15-9-12-20-18(15)21-17/h2-9,12H,10-11,13-14H2,1H3,(H,20,21).
What are the key properties of 6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine?
6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 307.40 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxy-4-phenylpiperidin-1-yl)-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 56909493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).