5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine

C19H21N3 — CID 10565529

IUPAC5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine
SMILESCc1cc(N2CCCCC2)c2[nH]c(-c3ccccc3)cc2n1
InChIInChI=1S/C19H21N3/c1-14-12-18(22-10-6-3-7-11-22)19-17(20-14)13-16(21-19)15-8-4-2-5-9-15/h2,4-5,8-9,12-13,21H,3,6-7,10-11H2,1H3
InChIKeyFOSDWGMVXWNOFC-UHFFFAOYSA-N
MW291.40 g/mol
LogP4.53
Rot. Bonds2

About 5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine

5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine (PubChem CID 10565529) has the molecular formula C19H21N3 and a molecular weight of 291.40 g/mol. Its IUPAC name is 5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine
PubChem CID10565529
Molecular FormulaC19H21N3
Molecular Weight291.40 g/mol
Exact Mass291.17
IUPAC Name5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine
SMILESCc1cc(N2CCCCC2)c2[nH]c(-c3ccccc3)cc2n1
InChIInChI=1S/C19H21N3/c1-14-12-18(22-10-6-3-7-11-22)19-17(20-14)13-16(21-19)15-8-4-2-5-9-15/h2,4-5,8-9,12-13,21H,3,6-7,10-11H2,1H3
InChIKeyFOSDWGMVXWNOFC-UHFFFAOYSA-N
XLogP4.53
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine?
The IUPAC name of 5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine (CID 10565529) is 5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for 5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine is Cc1cc(N2CCCCC2)c2[nH]c(-c3ccccc3)cc2n1.
What is the InChIKey of 5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine?
The InChIKey is FOSDWGMVXWNOFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3/c1-14-12-18(22-10-6-3-7-11-22)19-17(20-14)13-16(21-19)15-8-4-2-5-9-15/h2,4-5,8-9,12-13,21H,3,6-7,10-11H2,1H3.
What are the key properties of 5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine?
5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine has a molecular weight of 291.40 g/mol, XLogP of 4.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-phenyl-7-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 10565529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).