6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine

C14H19ClN4 — CID 82144465

IUPAC6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine
SMILESCCCc1nc2cc(Cl)cnc2n1C1CCNCC1
InChIInChI=1S/C14H19ClN4/c1-2-3-13-18-12-8-10(15)9-17-14(12)19(13)11-4-6-16-7-5-11/h8-9,11,16H,2-7H2,1H3
InChIKeyFODHPTPGRLWMIS-UHFFFAOYSA-N
MW278.79 g/mol
LogP2.96
Rot. Bonds3

About 6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine

6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine (PubChem CID 82144465) has the molecular formula C14H19ClN4 and a molecular weight of 278.79 g/mol. Its IUPAC name is 6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine
PubChem CID82144465
Molecular FormulaC14H19ClN4
Molecular Weight278.79 g/mol
Exact Mass278.13
IUPAC Name6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine
SMILESCCCc1nc2cc(Cl)cnc2n1C1CCNCC1
InChIInChI=1S/C14H19ClN4/c1-2-3-13-18-12-8-10(15)9-17-14(12)19(13)11-4-6-16-7-5-11/h8-9,11,16H,2-7H2,1H3
InChIKeyFODHPTPGRLWMIS-UHFFFAOYSA-N
XLogP2.96
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.79
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine?
The IUPAC name of 6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine (CID 82144465) is 6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine.
What is the SMILES notation for 6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine?
The canonical SMILES for 6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine is CCCc1nc2cc(Cl)cnc2n1C1CCNCC1.
What is the InChIKey of 6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine?
The InChIKey is FODHPTPGRLWMIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN4/c1-2-3-13-18-12-8-10(15)9-17-14(12)19(13)11-4-6-16-7-5-11/h8-9,11,16H,2-7H2,1H3.
What are the key properties of 6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine?
6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine has a molecular weight of 278.79 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine is sourced from PubChem (CID 82144465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).