N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine

C24H26FN5O2 — CID 66781550

IUPACN-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine
SMILESCOCCOc1ccn2c(-c3ccc4cccc(N[C@@H]5CCNC[C@@H]5F)c4n3)cnc2c1
InChIInChI=1S/C24H26FN5O2/c1-31-11-12-32-17-8-10-30-22(15-27-23(30)13-17)20-6-5-16-3-2-4-21(24(16)29-20)28-19-7-9-26-14-18(19)25/h2-6,8,10,13,15,18-19,26,28H,7,9,11-12,14H2,1H3/t18-,19+/m0/s1
InChIKeyHTQYVNDQWIJFQA-RBUKOAKNSA-N
MW435.50 g/mol
LogP3.69
Rot. Bonds7

About N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine

N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine (PubChem CID 66781550) has the molecular formula C24H26FN5O2 and a molecular weight of 435.50 g/mol. Its IUPAC name is N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine.

Molecular Properties

Compound NameN-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine
PubChem CID66781550
Molecular FormulaC24H26FN5O2
Molecular Weight435.50 g/mol
Exact Mass435.21
IUPAC NameN-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine
SMILESCOCCOc1ccn2c(-c3ccc4cccc(N[C@@H]5CCNC[C@@H]5F)c4n3)cnc2c1
InChIInChI=1S/C24H26FN5O2/c1-31-11-12-32-17-8-10-30-22(15-27-23(30)13-17)20-6-5-16-3-2-4-21(24(16)29-20)28-19-7-9-26-14-18(19)25/h2-6,8,10,13,15,18-19,26,28H,7,9,11-12,14H2,1H3/t18-,19+/m0/s1
InChIKeyHTQYVNDQWIJFQA-RBUKOAKNSA-N
XLogP3.69
TPSA72.71 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.50
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine with MolForge

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

Launch Full Analysis

Related Compounds

2-[3-[8-[(3S,4S)-3-fluoropiperidin-4-yl]oxyquinolin-2-yl]imidazo[1,2-a]pyridin-7-yl]oxyethanol
CID 59176335
2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]-8-[(3R)-3-methylpiperazin-1-yl]quinoline
CID 59363450
(3S)-1-[2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-yl]pyrrolidin-3-amine
CID 59363494
1-[2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-yl]piperidin-4-one
CID 68600936
2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]-8-[(1-methylpyrrolidin-3-yl)methoxy]quinoline
CID 59176341
6-[7-(difluoromethoxy)imidazo[1,2-a]pyridin-3-yl]-N-[(3S,4S)-4-fluoropiperidin-3-yl]pyridin-2-amine
CID 166961592
[2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-yl] trifluoromethanesulfonate
CID 86642347
1-[2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]-6-(trifluoromethyl)quinolin-8-yl]piperidin-4-amine
CID 59363452
8-[(3R,4R)-3-fluoropiperidin-4-yl]oxy-2-[7-(oxan-4-yloxy)imidazo[1,2-a]pyridin-3-yl]quinoline;dihydrochloride
CID 66782217
6-(7-cyclopropyloxyimidazo[1,2-a]pyridin-3-yl)-N-(4-fluoropiperidin-3-yl)pyridin-2-amine
CID 169129599
8-[(3S)-3-fluoropiperidin-4-yl]oxy-2-[7-[(3R)-oxolan-3-yl]oxyimidazo[1,2-a]pyridin-3-yl]quinoline
CID 59176345
8-[(3S)-3-fluoropiperidin-4-yl]oxy-2-[7-[(3S)-oxolan-3-yl]oxyimidazo[1,2-a]pyridin-3-yl]quinoline
CID 59176310

Frequently Asked Questions

What is the IUPAC name of N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine?
The IUPAC name of N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine (CID 66781550) is N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine.
What is the SMILES notation for N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine?
The canonical SMILES for N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine is COCCOc1ccn2c(-c3ccc4cccc(N[C@@H]5CCNC[C@@H]5F)c4n3)cnc2c1.
What is the InChIKey of N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine?
The InChIKey is HTQYVNDQWIJFQA-RBUKOAKNSA-N. The full InChI is InChI=1S/C24H26FN5O2/c1-31-11-12-32-17-8-10-30-22(15-27-23(30)13-17)20-6-5-16-3-2-4-21(24(16)29-20)28-19-7-9-26-14-18(19)25/h2-6,8,10,13,15,18-19,26,28H,7,9,11-12,14H2,1H3/t18-,19+/m0/s1.
What are the key properties of N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine?
N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine has a molecular weight of 435.50 g/mol, XLogP of 3.69, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S,4R)-3-fluoropiperidin-4-yl]-2-[7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-3-yl]quinolin-8-amine is sourced from PubChem (CID 66781550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).