N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one

C88H84N18O7S — CID 159744381

About N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one

N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one (PubChem CID 159744381) has the molecular formula C88H84N18O7S and a molecular weight of 1537.83 g/mol. Its IUPAC name is N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one.

Molecular Properties

• Compound Name: N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
• PubChem CID: 159744381
• Molecular Formula: C88H84N18O7S
• Molecular Weight: 1537.83 g/mol
• Exact Mass: 1536.65
• IUPAC Name: N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
• SMILES: COc1cccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)c1.CS(=O)(=O)c1cccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)c1.Cc1ccc(-c2ccc(Nc3ccc(N4CCN(C(C)C)CC4)cc3)c3nccn23)cc1C.O=C(NC1CC1)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1
• InChI: InChI=1S/C28H33N5.C22H19N5O2.C19H16N4O3S.C19H16N4O2/c1-20(2)31-15-17-32(18-16-31)25-9-7-24(8-10-25)30-26-11-12-27(33-14-13-29-28(26)33)23-6-5-21(3)22(4)19-23;28-20-13-15(9-10-23-20)19-8-7-18(21-24-11-12-27(19)21)25-16-3-1-14(2-4-16)22(29)26-17-5-6-17;1-27(25,26)15-4-2-3-14(12-15)22-16-5-6-17(23-10-9-21-19(16)23)13-7-8-20-18(24)11-13;1-25-15-4-2-3-14(12-15)22-16-5-6-17(23-10-9-21-19(16)23)13-7-8-20-18(24)11-13/h5-14,19-20,30H,15-18H2,1-4H3;1-4,7-13,17,25H,5-6H2,(H,23,28)(H,26,29);2-12,22H,1H3,(H,20,24);2-12,22H,1H3,(H,20,24)
• InChIKey: NCVYPEQTMOLNQC-UHFFFAOYSA-N
• XLogP: 15.50
• TPSA: 294.85 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 21
• Rotatable Bonds: 18
• Heavy Atoms: 114
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1537.83
LogP ≤ 5	15.50
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?

The IUPAC name of N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one (CID 159744381) is N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one.

What is the SMILES notation for N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?

The canonical SMILES for N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one is COc1cccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)c1.CS(=O)(=O)c1cccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)c1.Cc1ccc(-c2ccc(Nc3ccc(N4CCN(C(C)C)CC4)cc3)c3nccn23)cc1C.O=C(NC1CC1)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.

What is the InChIKey of N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?

The InChIKey is NCVYPEQTMOLNQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H33N5.C22H19N5O2.C19H16N4O3S.C19H16N4O2/c1-20(2)31-15-17-32(18-16-31)25-9-7-24(8-10-25)30-26-11-12-27(33-14-13-29-28(26)33)23-6-5-21(3)22(4)19-23;28-20-13-15(9-10-23-20)19-8-7-18(21-24-11-12-27(19)21)25-16-3-1-14(2-4-16)22(29)26-17-5-6-17;1-27(25,26)15-4-2-3-14(12-15)22-16-5-6-17(23-10-9-21-19(16)23)13-7-8-20-18(24)11-13;1-25-15-4-2-3-14(12-15)22-16-5-6-17(23-10-9-21-19(16)23)13-7-8-20-18(24)11-13/h5-14,19-20,30H,15-18H2,1-4H3;1-4,7-13,17,25H,5-6H2,(H,23,28)(H,26,29);2-12,22H,1H3,(H,20,24);2-12,22H,1H3,(H,20,24).

What are the key properties of N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?

N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one has a molecular weight of 1537.83 g/mol, XLogP of 15.50, 18 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for N-cyclopropyl-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;5-(3,4-dimethylphenyl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-8-amine;4-[8-(3-methoxyanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-(3-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one is sourced from PubChem (CID 159744381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).