3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate

C125H114Cl5N24O11P — CID 159754189

About 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate

3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate (PubChem CID 159754189) has the molecular formula C125H114Cl5N24O11P and a molecular weight of 2336.68 g/mol. Its IUPAC name is 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate.

Molecular Properties

• Compound Name: 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate
• PubChem CID: 159754189
• Molecular Formula: C125H114Cl5N24O11P
• Molecular Weight: 2336.68 g/mol
• Exact Mass: 2332.73
• IUPAC Name: 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate
• SMILES: CCOC(=O)C=P(c1ccccc1)(c1ccccc1)c1ccccc1.COC(=O)/C=C/c1cc(C2CC2)cn2cc(Cn3cc(C(=O)CCc4ncn5ccc(Cl)cc45)cn3)nc12.O=C(CCc1ncn2ccc(Cl)cc12)c1cn[nH]c1.O=C(CCc1ncn2ccc(Cl)cc12)c1cnn(Cc2cn3cc(C4CC4)cc(CO)c3n2)c1.O=Cc1cc(C2CC2)cn2cc(Cn3cc(C(=O)CCc4ncn5ccc(Cl)cc45)cn3)nc12.OCc1cc(C2CC2)cn2cc(CCl)nc12
• InChI: InChI=1S/C28H25ClN6O3.C25H23ClN6O2.C25H21ClN6O2.C22H21O2P.C13H11ClN4O.C12H13ClN2O/c1-38-27(37)7-4-19-10-20(18-2-3-18)13-34-15-23(32-28(19)34)16-35-14-21(12-31-35)26(36)6-5-24-25-11-22(29)8-9-33(25)17-30-24;2*26-20-5-6-30-15-27-22(23(30)8-20)3-4-24(34)19-9-28-32(11-19)13-21-12-31-10-17(16-1-2-16)7-18(14-33)25(31)29-21;1-2-24-22(23)18-25(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;14-10-3-4-18-8-15-11(12(18)5-10)1-2-13(19)9-6-16-17-7-9;13-4-11-6-15-5-9(8-1-2-8)3-10(7-16)12(15)14-11/h4,7-15,17-18H,2-3,5-6,16H2,1H3;5-12,15-16,33H,1-4,13-14H2;5-12,14-16H,1-4,13H2;3-18H,2H2,1H3;3-8H,1-2H2,(H,16,17);3,5-6,8,16H,1-2,4,7H2/b7-4+
• InChIKey: NEASADCWAYIMED-UCNBBMSTSA-N
• XLogP: 21.53
• TPSA: 398.95 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 34
• Rotatable Bonds: 37
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2336.68
LogP ≤ 5	21.53
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate?

The IUPAC name of 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate (CID 159754189) is 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate.

What is the SMILES notation for 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate?

The canonical SMILES for 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate is CCOC(=O)C=P(c1ccccc1)(c1ccccc1)c1ccccc1.COC(=O)/C=C/c1cc(C2CC2)cn2cc(Cn3cc(C(=O)CCc4ncn5ccc(Cl)cc45)cn3)nc12.O=C(CCc1ncn2ccc(Cl)cc12)c1cn[nH]c1.O=C(CCc1ncn2ccc(Cl)cc12)c1cnn(Cc2cn3cc(C4CC4)cc(CO)c3n2)c1.O=Cc1cc(C2CC2)cn2cc(Cn3cc(C(=O)CCc4ncn5ccc(Cl)cc45)cn3)nc12.OCc1cc(C2CC2)cn2cc(CCl)nc12.

What is the InChIKey of 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate?

The InChIKey is NEASADCWAYIMED-UCNBBMSTSA-N. The full InChI is InChI=1S/C28H25ClN6O3.C25H23ClN6O2.C25H21ClN6O2.C22H21O2P.C13H11ClN4O.C12H13ClN2O/c1-38-27(37)7-4-19-10-20(18-2-3-18)13-34-15-23(32-28(19)34)16-35-14-21(12-31-35)26(36)6-5-24-25-11-22(29)8-9-33(25)17-30-24;2*26-20-5-6-30-15-27-22(23(30)8-20)3-4-24(34)19-9-28-32(11-19)13-21-12-31-10-17(16-1-2-16)7-18(14-33)25(31)29-21;1-2-24-22(23)18-25(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;14-10-3-4-18-8-15-11(12(18)5-10)1-2-13(19)9-6-16-17-7-9;13-4-11-6-15-5-9(8-1-2-8)3-10(7-16)12(15)14-11/h4,7-15,17-18H,2-3,5-6,16H2,1H3;5-12,15-16,33H,1-4,13-14H2;5-12,14-16H,1-4,13H2;3-18H,2H2,1H3;3-8H,1-2H2,(H,16,17);3,5-6,8,16H,1-2,4,7H2/b7-4+;;;;;.

What are the key properties of 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate?

3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate has a molecular weight of 2336.68 g/mol, XLogP of 21.53, 37 rotatable bonds, 3 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;ethyl 2-(triphenyl-λ5-phosphanylidene)acetate;methyl (E)-3-[2-[[4-[3-(7-chloroimidazo[1,5-a]pyridin-1-yl)propanoyl]pyrazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]prop-2-enoate is sourced from PubChem (CID 159754189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).