N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide

C26H22N4O2 — CID 56530573

IUPACN-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide
SMILESCc1ccc2nc(C)c(C(=O)Nc3cccc(OCc4cn5ccccc5n4)c3)cc2c1
InChIInChI=1S/C26H22N4O2/c1-17-9-10-24-19(12-17)13-23(18(2)27-24)26(31)29-20-6-5-7-22(14-20)32-16-21-15-30-11-4-3-8-25(30)28-21/h3-15H,16H2,1-2H3,(H,29,31)
InChIKeyBRHFVNBTIDOWCP-UHFFFAOYSA-N
MW422.49 g/mol
LogP5.33
Rot. Bonds5

About N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide

N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide (PubChem CID 56530573) has the molecular formula C26H22N4O2 and a molecular weight of 422.49 g/mol. Its IUPAC name is N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide.

Molecular Properties

Compound NameN-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide
PubChem CID56530573
Molecular FormulaC26H22N4O2
Molecular Weight422.49 g/mol
Exact Mass422.17
IUPAC NameN-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide
SMILESCc1ccc2nc(C)c(C(=O)Nc3cccc(OCc4cn5ccccc5n4)c3)cc2c1
InChIInChI=1S/C26H22N4O2/c1-17-9-10-24-19(12-17)13-23(18(2)27-24)26(31)29-20-6-5-7-22(14-20)32-16-21-15-30-11-4-3-8-25(30)28-21/h3-15H,16H2,1-2H3,(H,29,31)
InChIKeyBRHFVNBTIDOWCP-UHFFFAOYSA-N
XLogP5.33
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.49
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]naphthalene-1-carboxamide
CID 56537813
7-fluoro-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-methylquinoline-4-carboxamide
CID 56530756
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,4-dimethoxybenzamide
CID 56530511
4-ethyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56530964
2-(2-ethoxyethoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56582400
N-[3-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)anilino]-3-oxopropyl]-2-methylbenzamide
CID 56582654
4-[ethyl(methyl)amino]-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56530641
methyl 2-[[3-[[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]benzoyl]amino]acetate
CID 55848603
2-(2-amino-2-oxoethyl)sulfanyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56537715
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-4-methylsulfonylbenzamide
CID 56530937
3,4-difluoro-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56530610
3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide
CID 56530800

Frequently Asked Questions

What is the IUPAC name of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide?
The IUPAC name of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide (CID 56530573) is N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide.
What is the SMILES notation for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide?
The canonical SMILES for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide is Cc1ccc2nc(C)c(C(=O)Nc3cccc(OCc4cn5ccccc5n4)c3)cc2c1.
What is the InChIKey of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide?
The InChIKey is BRHFVNBTIDOWCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N4O2/c1-17-9-10-24-19(12-17)13-23(18(2)27-24)26(31)29-20-6-5-7-22(14-20)32-16-21-15-30-11-4-3-8-25(30)28-21/h3-15H,16H2,1-2H3,(H,29,31).
What are the key properties of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide?
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide has a molecular weight of 422.49 g/mol, XLogP of 5.33, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,6-dimethylquinoline-3-carboxamide is sourced from PubChem (CID 56530573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).