7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one

C118H131ClN30O16 — CID 158714286

About 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one

7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one (PubChem CID 158714286) has the molecular formula C118H131ClN30O16 and a molecular weight of 2260.99 g/mol. Its IUPAC name is 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one.

Molecular Properties

• Compound Name: 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one
• PubChem CID: 158714286
• Molecular Formula: C118H131ClN30O16
• Molecular Weight: 2260.99 g/mol
• Exact Mass: 2259.00
• IUPAC Name: 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one
• SMILES: CCCC1CC(=O)N(Cc2ccnc3c2ncn3Cc2ccc(OC)cc2)C1.CCCC1CC(=O)N(Cc2ccnc3nc[nH]c23)C1.CCCC1CNC(=O)C1.CCc1ccc(OC)cc1.COC(=O)c1ccnc2nc[nH]c12.COC(=O)c1ccnc2nc[nH]c12.COc1ccc(Cn2cnc3c(CCl)ccnc32)cc1.COc1ccc(Cn2cnc3c(CO)ccnc32)cc1.Cc1ccnc(N)c1[N+](=O)[O-].Cc1ccnc2nc[nH]c12.O=C(O)c1ccnc2nc[nH]c12
• InChI: InChI=1S/C22H26N4O2.C15H14ClN3O.C15H15N3O2.C14H18N4O.C9H12O.2C8H7N3O2.C7H5N3O2.C7H7N3.C7H13NO.C6H7N3O2/c1-3-4-17-11-20(27)25(13-17)14-18-9-10-23-22-21(18)24-15-26(22)12-16-5-7-19(28-2)8-6-16;1-20-13-4-2-11(3-5-13)9-19-10-18-14-12(8-16)6-7-17-15(14)19;1-20-13-4-2-11(3-5-13)8-18-10-17-14-12(9-19)6-7-16-15(14)18;1-2-3-10-6-12(19)18(7-10)8-11-4-5-15-14-13(11)16-9-17-14;1-3-8-4-6-9(10-2)7-5-8;2*1-13-8(12)5-2-3-9-7-6(5)10-4-11-7;11-7(12)4-1-2-8-6-5(4)9-3-10-6;1-5-2-3-8-7-6(5)9-4-10-7;1-2-3-6-4-7(9)8-5-6;1-4-2-3-8-6(7)5(4)9(10)11/h5-10,15,17H,3-4,11-14H2,1-2H3;2-7,10H,8-9H2,1H3;2-7,10,19H,8-9H2,1H3;4-5,9-10H,2-3,6-8H2,1H3,(H,15,16,17);4-7H,3H2,1-2H3;2*2-4H,1H3,(H,9,10,11);1-3H,(H,11,12)(H,8,9,10);2-4H,1H3,(H,8,9,10);6H,2-5H2,1H3,(H,8,9);2-3H,1H3,(H2,7,8)
• InChIKey: IJCQQFXYXNBDES-UHFFFAOYSA-N
• XLogP: 18.42
• TPSA: 598.80 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 36
• Rotatable Bonds: 27
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2260.99
LogP ≤ 5	18.42
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one?

The IUPAC name of 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one (CID 158714286) is 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one.

What is the SMILES notation for 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one?

The canonical SMILES for 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one is CCCC1CC(=O)N(Cc2ccnc3c2ncn3Cc2ccc(OC)cc2)C1.CCCC1CC(=O)N(Cc2ccnc3nc[nH]c23)C1.CCCC1CNC(=O)C1.CCc1ccc(OC)cc1.COC(=O)c1ccnc2nc[nH]c12.COC(=O)c1ccnc2nc[nH]c12.COc1ccc(Cn2cnc3c(CCl)ccnc32)cc1.COc1ccc(Cn2cnc3c(CO)ccnc32)cc1.Cc1ccnc(N)c1[N+](=O)[O-].Cc1ccnc2nc[nH]c12.O=C(O)c1ccnc2nc[nH]c12.

What is the InChIKey of 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one?

The InChIKey is IJCQQFXYXNBDES-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O2.C15H14ClN3O.C15H15N3O2.C14H18N4O.C9H12O.2C8H7N3O2.C7H5N3O2.C7H7N3.C7H13NO.C6H7N3O2/c1-3-4-17-11-20(27)25(13-17)14-18-9-10-23-22-21(18)24-15-26(22)12-16-5-7-19(28-2)8-6-16;1-20-13-4-2-11(3-5-13)9-19-10-18-14-12(8-16)6-7-17-15(14)19;1-20-13-4-2-11(3-5-13)8-18-10-17-14-12(9-19)6-7-16-15(14)18;1-2-3-10-6-12(19)18(7-10)8-11-4-5-15-14-13(11)16-9-17-14;1-3-8-4-6-9(10-2)7-5-8;2*1-13-8(12)5-2-3-9-7-6(5)10-4-11-7;11-7(12)4-1-2-8-6-5(4)9-3-10-6;1-5-2-3-8-7-6(5)9-4-10-7;1-2-3-6-4-7(9)8-5-6;1-4-2-3-8-6(7)5(4)9(10)11/h5-10,15,17H,3-4,11-14H2,1-2H3;2-7,10H,8-9H2,1H3;2-7,10,19H,8-9H2,1H3;4-5,9-10H,2-3,6-8H2,1H3,(H,15,16,17);4-7H,3H2,1-2H3;2*2-4H,1H3,(H,9,10,11);1-3H,(H,11,12)(H,8,9,10);2-4H,1H3,(H,8,9,10);6H,2-5H2,1H3,(H,8,9);2-3H,1H3,(H2,7,8).

What are the key properties of 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one?

7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one has a molecular weight of 2260.99 g/mol, XLogP of 18.42, 27 rotatable bonds, 9 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(chloromethyl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine;1-ethyl-4-methoxybenzene;1H-imidazo[4,5-b]pyridine-7-carboxylic acid;1-(1H-imidazo[4,5-b]pyridin-7-ylmethyl)-4-propylpyrrolidin-2-one;[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methanol;1-[[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-7-yl]methyl]-4-propylpyrrolidin-2-one;7-methyl-1H-imidazo[4,5-b]pyridine;bis(methyl 1H-imidazo[4,5-b]pyridine-7-carboxylate);4-methyl-3-nitropyridin-2-amine;4-propylpyrrolidin-2-one is sourced from PubChem (CID 158714286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).