3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine

C15H22N4O — CID 66785612

IUPAC3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine
SMILESCOCCCn1c([C@@H]2CCCNC2)nc2ccncc21
InChIInChI=1S/C15H22N4O/c1-20-9-3-8-19-14-11-17-7-5-13(14)18-15(19)12-4-2-6-16-10-12/h5,7,11-12,16H,2-4,6,8-10H2,1H3/t12-/m1/s1
InChIKeyUOGAQPIBUBESAW-GFCCVEGCSA-N
MW274.37 g/mol
LogP1.93
Rot. Bonds5

About 3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine

3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine (PubChem CID 66785612) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine
PubChem CID66785612
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine
SMILESCOCCCn1c([C@@H]2CCCNC2)nc2ccncc21
InChIInChI=1S/C15H22N4O/c1-20-9-3-8-19-14-11-17-7-5-13(14)18-15(19)12-4-2-6-16-10-12/h5,7,11-12,16H,2-4,6,8-10H2,1H3/t12-/m1/s1
InChIKeyUOGAQPIBUBESAW-GFCCVEGCSA-N
XLogP1.93
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine?
The IUPAC name of 3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine (CID 66785612) is 3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine.
What is the SMILES notation for 3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine?
The canonical SMILES for 3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine is COCCCn1c([C@@H]2CCCNC2)nc2ccncc21.
What is the InChIKey of 3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine?
The InChIKey is UOGAQPIBUBESAW-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H22N4O/c1-20-9-3-8-19-14-11-17-7-5-13(14)18-15(19)12-4-2-6-16-10-12/h5,7,11-12,16H,2-4,6,8-10H2,1H3/t12-/m1/s1.
What are the key properties of 3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine?
3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine has a molecular weight of 274.37 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxypropyl)-2-[(3R)-piperidin-3-yl]imidazo[4,5-c]pyridine is sourced from PubChem (CID 66785612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).