7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine

C21H20N4 — CID 57462542

IUPAC7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine
SMILESc1ccc2cc(-c3ccnc4c3ncn4[C@@H]3CCCNC3)ccc2c1
InChIInChI=1S/C21H20N4/c1-2-5-16-12-17(8-7-15(16)4-1)19-9-11-23-21-20(19)24-14-25(21)18-6-3-10-22-13-18/h1-2,4-5,7-9,11-12,14,18,22H,3,6,10,13H2/t18-/m1/s1
InChIKeyMVLZYHHPJIEJOB-GOSISDBHSA-N
MW328.42 g/mol
LogP4.18
Rot. Bonds2

About 7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine

7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine (PubChem CID 57462542) has the molecular formula C21H20N4 and a molecular weight of 328.42 g/mol. Its IUPAC name is 7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine
PubChem CID57462542
Molecular FormulaC21H20N4
Molecular Weight328.42 g/mol
Exact Mass328.17
IUPAC Name7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine
SMILESc1ccc2cc(-c3ccnc4c3ncn4[C@@H]3CCCNC3)ccc2c1
InChIInChI=1S/C21H20N4/c1-2-5-16-12-17(8-7-15(16)4-1)19-9-11-23-21-20(19)24-14-25(21)18-6-3-10-22-13-18/h1-2,4-5,7-9,11-12,14,18,22H,3,6,10,13H2/t18-/m1/s1
InChIKeyMVLZYHHPJIEJOB-GOSISDBHSA-N
XLogP4.18
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine?
The IUPAC name of 7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine (CID 57462542) is 7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine.
What is the SMILES notation for 7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine?
The canonical SMILES for 7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine is c1ccc2cc(-c3ccnc4c3ncn4[C@@H]3CCCNC3)ccc2c1.
What is the InChIKey of 7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine?
The InChIKey is MVLZYHHPJIEJOB-GOSISDBHSA-N. The full InChI is InChI=1S/C21H20N4/c1-2-5-16-12-17(8-7-15(16)4-1)19-9-11-23-21-20(19)24-14-25(21)18-6-3-10-22-13-18/h1-2,4-5,7-9,11-12,14,18,22H,3,6,10,13H2/t18-/m1/s1.
What are the key properties of 7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine?
7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine has a molecular weight of 328.42 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-naphthalen-2-yl-3-[(3R)-piperidin-3-yl]imidazo[4,5-b]pyridine is sourced from PubChem (CID 57462542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).