3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid

C150H154N8O24 — CID 157390861

About 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid

3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid (PubChem CID 157390861) has the molecular formula C150H154N8O24 and a molecular weight of 2452.91 g/mol. Its IUPAC name is 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid.

Molecular Properties

• Compound Name: 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid
• PubChem CID: 157390861
• Molecular Formula: C150H154N8O24
• Molecular Weight: 2452.91 g/mol
• Exact Mass: 2451.11
• IUPAC Name: 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid
• SMILES: Cc1ccc2c(c1)C(CCc1cnccc1C(=O)O)CCO2.Cc1ccc2c(c1)OCCC2CCc1cnccc1C(=O)O.Cc1ccc2c(c1)OCCC2CCc1cnccc1C(=O)O.Cc1ccc2c(c1)OCCC2CCc1cnccc1C(=O)O.Cc1cccc2c1OCCC2CCc1cnccc1C(=O)O.O=C(O)c1ccncc1CCC1CCOc2cc(-c3ccccc3)ccc21.O=C(O)c1ccncc1CCC1CCOc2cc(C3CC3)ccc21.O=C(O)c1ccncc1CCC1CCOc2ccccc21
• InChI: InChI=1S/C23H21NO3.C20H21NO3.5C18H19NO3.C17H17NO3/c25-23(26)21-10-12-24-15-19(21)7-6-17-11-13-27-22-14-18(8-9-20(17)22)16-4-2-1-3-5-16;22-20(23)18-7-9-21-12-16(18)4-3-14-8-10-24-19-11-15(13-1-2-13)5-6-17(14)19;1-12-2-5-17-16(10-12)13(7-9-22-17)3-4-14-11-19-8-6-15(14)18(20)21;3*1-12-2-5-15-13(7-9-22-17(15)10-12)3-4-14-11-19-8-6-16(14)18(20)21;1-12-3-2-4-15-13(8-10-22-17(12)15)5-6-14-11-19-9-7-16(14)18(20)21;19-17(20)15-7-9-18-11-13(15)6-5-12-8-10-21-16-4-2-1-3-14(12)16/h1-5,8-10,12,14-15,17H,6-7,11,13H2,(H,25,26);5-7,9,11-14H,1-4,8,10H2,(H,22,23);4*2,5-6,8,10-11,13H,3-4,7,9H2,1H3,(H,20,21);2-4,7,9,11,13H,5-6,8,10H2,1H3,(H,20,21);1-4,7,9,11-12H,5-6,8,10H2,(H,19,20)
• InChIKey: BLZHNQXIECMCMQ-UHFFFAOYSA-N
• XLogP: 30.32
• TPSA: 475.36 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 24
• Rotatable Bonds: 34
• Heavy Atoms: 182
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2452.91
LogP ≤ 5	30.32
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid?

The IUPAC name of 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid (CID 157390861) is 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid.

What is the SMILES notation for 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid?

The canonical SMILES for 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid is Cc1ccc2c(c1)C(CCc1cnccc1C(=O)O)CCO2.Cc1ccc2c(c1)OCCC2CCc1cnccc1C(=O)O.Cc1ccc2c(c1)OCCC2CCc1cnccc1C(=O)O.Cc1ccc2c(c1)OCCC2CCc1cnccc1C(=O)O.Cc1cccc2c1OCCC2CCc1cnccc1C(=O)O.O=C(O)c1ccncc1CCC1CCOc2cc(-c3ccccc3)ccc21.O=C(O)c1ccncc1CCC1CCOc2cc(C3CC3)ccc21.O=C(O)c1ccncc1CCC1CCOc2ccccc21.

What is the InChIKey of 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid?

The InChIKey is BLZHNQXIECMCMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO3.C20H21NO3.5C18H19NO3.C17H17NO3/c25-23(26)21-10-12-24-15-19(21)7-6-17-11-13-27-22-14-18(8-9-20(17)22)16-4-2-1-3-5-16;22-20(23)18-7-9-21-12-16(18)4-3-14-8-10-24-19-11-15(13-1-2-13)5-6-17(14)19;1-12-2-5-17-16(10-12)13(7-9-22-17)3-4-14-11-19-8-6-15(14)18(20)21;3*1-12-2-5-15-13(7-9-22-17(15)10-12)3-4-14-11-19-8-6-16(14)18(20)21;1-12-3-2-4-15-13(8-10-22-17(12)15)5-6-14-11-19-9-7-16(14)18(20)21;19-17(20)15-7-9-18-11-13(15)6-5-12-8-10-21-16-4-2-1-3-14(12)16/h1-5,8-10,12,14-15,17H,6-7,11,13H2,(H,25,26);5-7,9,11-14H,1-4,8,10H2,(H,22,23);4*2,5-6,8,10-11,13H,3-4,7,9H2,1H3,(H,20,21);2-4,7,9,11,13H,5-6,8,10H2,1H3,(H,20,21);1-4,7,9,11-12H,5-6,8,10H2,(H,19,20).

What are the key properties of 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid?

3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid has a molecular weight of 2452.91 g/mol, XLogP of 30.32, 34 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[2-(7-cyclopropyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(6-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;tris(3-[2-(7-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid);3-[2-(8-methyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid is sourced from PubChem (CID 157390861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).