N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide

C22H19N5O4 — CID 24598074

IUPACN-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
SMILESO=C(CNC(=O)c1ccco1)NCC(=O)Nc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C22H19N5O4/c28-20(12-24-22(30)18-4-3-11-31-18)23-13-21(29)25-16-8-6-15(7-9-16)17-14-27-10-2-1-5-19(27)26-17/h1-11,14H,12-13H2,(H,23,28)(H,24,30)(H,25,29)
InChIKeyZQTCMZYPMXKYQD-UHFFFAOYSA-N
MW417.43 g/mol
LogP2.08
Rot. Bonds7

About N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide

N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide (PubChem CID 24598074) has the molecular formula C22H19N5O4 and a molecular weight of 417.43 g/mol. Its IUPAC name is N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
PubChem CID24598074
Molecular FormulaC22H19N5O4
Molecular Weight417.43 g/mol
Exact Mass417.14
IUPAC NameN-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
SMILESO=C(CNC(=O)c1ccco1)NCC(=O)Nc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C22H19N5O4/c28-20(12-24-22(30)18-4-3-11-31-18)23-13-21(29)25-16-8-6-15(7-9-16)17-14-27-10-2-1-5-19(27)26-17/h1-11,14H,12-13H2,(H,23,28)(H,24,30)(H,25,29)
InChIKeyZQTCMZYPMXKYQD-UHFFFAOYSA-N
XLogP2.08
TPSA117.74 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.43
LogP ≤ 52.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]-4-methyl-3-nitrobenzamide
CID 24598095
N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide
CID 9225396
2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)acetamide
CID 37051251
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
CID 122284110
2-(1-adamantyl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)acetamide
CID 122284090
2-bromo-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzamide
CID 3763346
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbenzamide
CID 40570291
1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(2-methylphenyl)urea
CID 121089798
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
CID 24598093
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-phenyl-1H-pyrazole-5-carboxamide
CID 24661435
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 18139273
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-5-methyl-1-phenylpyrazole-4-carboxamide
CID 24598852

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide?
The IUPAC name of N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide (CID 24598074) is N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide is O=C(CNC(=O)c1ccco1)NCC(=O)Nc1ccc(-c2cn3ccccc3n2)cc1.
What is the InChIKey of N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide?
The InChIKey is ZQTCMZYPMXKYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O4/c28-20(12-24-22(30)18-4-3-11-31-18)23-13-21(29)25-16-8-6-15(7-9-16)17-14-27-10-2-1-5-19(27)26-17/h1-11,14H,12-13H2,(H,23,28)(H,24,30)(H,25,29).
What are the key properties of N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide?
N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide has a molecular weight of 417.43 g/mol, XLogP of 2.08, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[2-(4-imidazo[1,2-a]pyridin-2-ylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide is sourced from PubChem (CID 24598074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).