2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide

C24H26N4O3S — CID 55949084

IUPAC2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide
SMILESCCCCc1nc(C)c(C(=O)Nc2ccc(OC)c(OCc3cn4ccccc4n3)c2)s1
InChIInChI=1S/C24H26N4O3S/c1-4-5-9-22-25-16(2)23(32-22)24(29)27-17-10-11-19(30-3)20(13-17)31-15-18-14-28-12-7-6-8-21(28)26-18/h6-8,10-14H,4-5,9,15H2,1-3H3,(H,27,29)
InChIKeyKUFBNHYZGRFWCF-UHFFFAOYSA-N
MW450.56 g/mol
LogP5.28
Rot. Bonds9

About 2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide

2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide (PubChem CID 55949084) has the molecular formula C24H26N4O3S and a molecular weight of 450.56 g/mol. Its IUPAC name is 2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide
PubChem CID55949084
Molecular FormulaC24H26N4O3S
Molecular Weight450.56 g/mol
Exact Mass450.17
IUPAC Name2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide
SMILESCCCCc1nc(C)c(C(=O)Nc2ccc(OC)c(OCc3cn4ccccc4n3)c2)s1
InChIInChI=1S/C24H26N4O3S/c1-4-5-9-22-25-16(2)23(32-22)24(29)27-17-10-11-19(30-3)20(13-17)31-15-18-14-28-12-7-6-8-21(28)26-18/h6-8,10-14H,4-5,9,15H2,1-3H3,(H,27,29)
InChIKeyKUFBNHYZGRFWCF-UHFFFAOYSA-N
XLogP5.28
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.56
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-amino-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-2-methylpropanamide
CID 119859743
4-(difluoromethylsulfanyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]benzamide
CID 52668432
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-5-methyl-1-benzofuran-2-carboxamide
CID 55949341
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-3-(methoxymethyl)-1-benzofuran-2-carboxamide
CID 55949079
4-(difluoromethylsulfonyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]benzamide
CID 55950861
3-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide
CID 55826214
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119859782
3-amino-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]cyclopentane-1-carboxamide
CID 119859749
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-2-pyrrolidin-2-ylacetamide
CID 119859777
1-(2,3-dimethylphenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-5-oxopyrrolidine-3-carboxamide
CID 55825518
N-[2-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyanilino]-2-oxoethyl]-4-oxo-1H-quinoline-3-carboxamide
CID 55949083
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]piperidine-1-sulfonamide
CID 155948919

Frequently Asked Questions

What is the IUPAC name of 2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide (CID 55949084) is 2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide is CCCCc1nc(C)c(C(=O)Nc2ccc(OC)c(OCc3cn4ccccc4n3)c2)s1.
What is the InChIKey of 2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is KUFBNHYZGRFWCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O3S/c1-4-5-9-22-25-16(2)23(32-22)24(29)27-17-10-11-19(30-3)20(13-17)31-15-18-14-28-12-7-6-8-21(28)26-18/h6-8,10-14H,4-5,9,15H2,1-3H3,(H,27,29).
What are the key properties of 2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide?
2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 450.56 g/mol, XLogP of 5.28, 9 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 55949084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).