N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine

C74H85ClN18O15S2 — CID 158140910

About N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine

N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine (PubChem CID 158140910) has the molecular formula C74H85ClN18O15S2 and a molecular weight of 1566.19 g/mol. Its IUPAC name is N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine.

Molecular Properties

• Compound Name: N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine
• PubChem CID: 158140910
• Molecular Formula: C74H85ClN18O15S2
• Molecular Weight: 1566.19 g/mol
• Exact Mass: 1564.56
• IUPAC Name: N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine
• SMILES: COc1cc(NC(=O)c2ccccn2)c(C(N)=O)cc1OC.COc1cc2nc(-c3ccccn3)[nH]c(=O)c2cc1OC.COc1cc2nc(-c3ccccn3)nc(Cl)c2cc1OC.COc1cc2nc(-c3ccccn3)nc(N3CCC(CCNS(N)(=O)=O)CC3)c2cc1OC.NS(=O)(=O)NCCC1CCNCC1
• InChI: InChI=1S/C22H28N6O4S.C15H12ClN3O2.C15H15N3O4.C15H13N3O3.C7H17N3O2S/c1-31-19-13-16-18(14-20(19)32-2)26-21(17-5-3-4-9-24-17)27-22(16)28-11-7-15(8-12-28)6-10-25-33(23,29)30;1-20-12-7-9-11(8-13(12)21-2)18-15(19-14(9)16)10-5-3-4-6-17-10;1-21-12-7-9(14(16)19)11(8-13(12)22-2)18-15(20)10-5-3-4-6-17-10;1-20-12-7-9-11(8-13(12)21-2)17-14(18-15(9)19)10-5-3-4-6-16-10;8-13(11,12)10-6-3-7-1-4-9-5-2-7/h3-5,9,13-15,25H,6-8,10-12H2,1-2H3,(H2,23,29,30);3-8H,1-2H3;3-8H,1-2H3,(H2,16,19)(H,18,20);3-8H,1-2H3,(H,17,18,19);7,9-10H,1-6H2,(H2,8,11,12)
• InChIKey: FTXRZBAEFPAQJS-UHFFFAOYSA-N
• XLogP: 8.09
• TPSA: 454.55 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 26
• Rotatable Bonds: 23
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1566.19
LogP ≤ 5	8.09
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine?

The IUPAC name of N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine (CID 158140910) is N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine.

What is the SMILES notation for N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine?

The canonical SMILES for N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine is COc1cc(NC(=O)c2ccccn2)c(C(N)=O)cc1OC.COc1cc2nc(-c3ccccn3)[nH]c(=O)c2cc1OC.COc1cc2nc(-c3ccccn3)nc(Cl)c2cc1OC.COc1cc2nc(-c3ccccn3)nc(N3CCC(CCNS(N)(=O)=O)CC3)c2cc1OC.NS(=O)(=O)NCCC1CCNCC1.

What is the InChIKey of N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine?

The InChIKey is FTXRZBAEFPAQJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N6O4S.C15H12ClN3O2.C15H15N3O4.C15H13N3O3.C7H17N3O2S/c1-31-19-13-16-18(14-20(19)32-2)26-21(17-5-3-4-9-24-17)27-22(16)28-11-7-15(8-12-28)6-10-25-33(23,29)30;1-20-12-7-9-11(8-13(12)21-2)18-15(19-14(9)16)10-5-3-4-6-17-10;1-21-12-7-9(14(16)19)11(8-13(12)22-2)18-15(20)10-5-3-4-6-17-10;1-20-12-7-9-11(8-13(12)21-2)17-14(18-15(9)19)10-5-3-4-6-16-10;8-13(11,12)10-6-3-7-1-4-9-5-2-7/h3-5,9,13-15,25H,6-8,10-12H2,1-2H3,(H2,23,29,30);3-8H,1-2H3;3-8H,1-2H3,(H2,16,19)(H,18,20);3-8H,1-2H3,(H,17,18,19);7,9-10H,1-6H2,(H2,8,11,12).

What are the key properties of N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine?

N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine has a molecular weight of 1566.19 g/mol, XLogP of 8.09, 23 rotatable bonds, 8 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-2-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-2-ylquinazoline;6,7-dimethoxy-2-pyridin-2-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-2-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;4-[2-(sulfamoylamino)ethyl]piperidine is sourced from PubChem (CID 158140910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).