3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine

C24H29ClN6O — CID 145424566

IUPAC3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
SMILESCOc1cccnc1[C@@H]1CCC[C@H](c2nc3cccc(N4CCNC5(CC5)C4)n3c2Cl)N1
InChIInChI=1S/C24H29ClN6O/c1-32-18-7-4-12-26-21(18)16-5-2-6-17(28-16)22-23(25)31-19(29-22)8-3-9-20(31)30-14-13-27-24(15-30)10-11-24/h3-4,7-9,12,16-17,27-28H,2,5-6,10-11,13-15H2,1H3/t16-,17+/m0/s1
InChIKeyMXZAPMUJDXDTMZ-DLBZAZTESA-N
MW452.99 g/mol
LogP3.89
Rot. Bonds4

About 3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine

3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine (PubChem CID 145424566) has the molecular formula C24H29ClN6O and a molecular weight of 452.99 g/mol. Its IUPAC name is 3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
PubChem CID145424566
Molecular FormulaC24H29ClN6O
Molecular Weight452.99 g/mol
Exact Mass452.21
IUPAC Name3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
SMILESCOc1cccnc1[C@@H]1CCC[C@H](c2nc3cccc(N4CCNC5(CC5)C4)n3c2Cl)N1
InChIInChI=1S/C24H29ClN6O/c1-32-18-7-4-12-26-21(18)16-5-2-6-17(28-16)22-23(25)31-19(29-22)8-3-9-20(31)30-14-13-27-24(15-30)10-11-24/h3-4,7-9,12,16-17,27-28H,2,5-6,10-11,13-15H2,1H3/t16-,17+/m0/s1
InChIKeyMXZAPMUJDXDTMZ-DLBZAZTESA-N
XLogP3.89
TPSA66.72 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500452.99
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
The IUPAC name of 3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine (CID 145424566) is 3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
The canonical SMILES for 3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine is COc1cccnc1[C@@H]1CCC[C@H](c2nc3cccc(N4CCNC5(CC5)C4)n3c2Cl)N1.
What is the InChIKey of 3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
The InChIKey is MXZAPMUJDXDTMZ-DLBZAZTESA-N. The full InChI is InChI=1S/C24H29ClN6O/c1-32-18-7-4-12-26-21(18)16-5-2-6-17(28-16)22-23(25)31-19(29-22)8-3-9-20(31)30-14-13-27-24(15-30)10-11-24/h3-4,7-9,12,16-17,27-28H,2,5-6,10-11,13-15H2,1H3/t16-,17+/m0/s1.
What are the key properties of 3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine has a molecular weight of 452.99 g/mol, XLogP of 3.89, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-(4,7-diazaspiro[2.5]octan-7-yl)-2-[(2R,6S)-6-(3-methoxy-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 145424566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).