4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide

C113H107N21O8 — CID 158303802

About 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide

4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide (PubChem CID 158303802) has the molecular formula C113H107N21O8 and a molecular weight of 1887.24 g/mol. Its IUPAC name is 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide.

Molecular Properties

• Compound Name: 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide
• PubChem CID: 158303802
• Molecular Formula: C113H107N21O8
• Molecular Weight: 1887.24 g/mol
• Exact Mass: 1885.86
• IUPAC Name: 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide
• SMILES: CCCN(CCC)C(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.CN(CCCNC(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1)c1ccccc1.O=C(c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1)N1CCC(Cc2ccccc2)CC1.O=C(c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1)N1CCc2ccccc2C1
• InChI: InChI=1S/C31H29N5O2.C29H28N6O2.C28H23N5O2.C25H27N5O2/c37-29-21-25(12-15-32-29)28-11-10-27(30-33-16-19-36(28)30)34-26-8-6-24(7-9-26)31(38)35-17-13-23(14-18-35)20-22-4-2-1-3-5-22;1-34(24-6-3-2-4-7-24)18-5-15-32-29(37)21-8-10-23(11-9-21)33-25-12-13-26(35-19-17-31-28(25)35)22-14-16-30-27(36)20-22;34-26-17-21(11-13-29-26)25-10-9-24(27-30-14-16-33(25)27)31-23-7-5-20(6-8-23)28(35)32-15-12-19-3-1-2-4-22(19)18-32;1-3-14-29(15-4-2)25(32)18-5-7-20(8-6-18)28-21-9-10-22(30-16-13-27-24(21)30)19-11-12-26-23(31)17-19/h1-12,15-16,19,21,23,34H,13-14,17-18,20H2,(H,32,37);2-4,6-14,16-17,19-20,33H,5,15,18H2,1H3,(H,30,36)(H,32,37);1-11,13-14,16-17,31H,12,15,18H2,(H,29,34);5-13,16-17,28H,3-4,14-15H2,1-2H3,(H,26,31)
• InChIKey: GMVBLBJSTHKPNE-UHFFFAOYSA-N
• XLogP: 19.54
• TPSA: 342.03 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 21
• Rotatable Bonds: 27
• Heavy Atoms: 142
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1887.24
LogP ≤ 5	19.54
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide?

The IUPAC name of 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide (CID 158303802) is 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide.

What is the SMILES notation for 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide?

The canonical SMILES for 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide is CCCN(CCC)C(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1.CN(CCCNC(=O)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1)c1ccccc1.O=C(c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1)N1CCC(Cc2ccccc2)CC1.O=C(c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1)N1CCc2ccccc2C1.

What is the InChIKey of 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide?

The InChIKey is GMVBLBJSTHKPNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H29N5O2.C29H28N6O2.C28H23N5O2.C25H27N5O2/c37-29-21-25(12-15-32-29)28-11-10-27(30-33-16-19-36(28)30)34-26-8-6-24(7-9-26)31(38)35-17-13-23(14-18-35)20-22-4-2-1-3-5-22;1-34(24-6-3-2-4-7-24)18-5-15-32-29(37)21-8-10-23(11-9-21)33-25-12-13-26(35-19-17-31-28(25)35)22-14-16-30-27(36)20-22;34-26-17-21(11-13-29-26)25-10-9-24(27-30-14-16-33(25)27)31-23-7-5-20(6-8-23)28(35)32-15-12-19-3-1-2-4-22(19)18-32;1-3-14-29(15-4-2)25(32)18-5-7-20(8-6-18)28-21-9-10-22(30-16-13-27-24(21)30)19-11-12-26-23(31)17-19/h1-12,15-16,19,21,23,34H,13-14,17-18,20H2,(H,32,37);2-4,6-14,16-17,19-20,33H,5,15,18H2,1H3,(H,30,36)(H,32,37);1-11,13-14,16-17,31H,12,15,18H2,(H,29,34);5-13,16-17,28H,3-4,14-15H2,1-2H3,(H,26,31).

What are the key properties of 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide?

4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide has a molecular weight of 1887.24 g/mol, XLogP of 19.54, 27 rotatable bonds, 9 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[8-[4-(4-benzylpiperidine-1-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[3-(N-methylanilino)propyl]-4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]benzamide;4-[[5-(2-oxo-1H-pyridin-4-yl)imidazo[1,2-a]pyridin-8-yl]amino]-N,N-dipropylbenzamide is sourced from PubChem (CID 158303802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).