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

C98H113ClN22O24S2 — CID 162035795

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

2-amino-4,5-dimethoxybenzamide;2-amino-4,5-dimethoxybenzoic acid;N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-4-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-4-ylquinazoline;6,7-dimethoxy-2-pyridin-4-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-4-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;pyridine-4-carboxylic acid;4-[2-(sulfamoylamino)ethyl]piperidine (PubChem CID 162035795) has the molecular formula C98H113ClN22O24S2 and a molecular weight of 2082.70 g/mol. Its IUPAC name is 2-amino-4,5-dimethoxybenzamide;2-amino-4,5-dimethoxybenzoic acid;N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-4-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-4-ylquinazoline;6,7-dimethoxy-2-pyridin-4-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-4-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;pyridine-4-carboxylic acid;4-[2-(sulfamoylamino)ethyl]piperidine.

Molecular Properties

• Compound Name: 2-amino-4,5-dimethoxybenzamide;2-amino-4,5-dimethoxybenzoic acid;N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-4-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-4-ylquinazoline;6,7-dimethoxy-2-pyridin-4-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-4-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;pyridine-4-carboxylic acid;4-[2-(sulfamoylamino)ethyl]piperidine
• PubChem CID: 162035795
• Molecular Formula: C98H113ClN22O24S2
• Molecular Weight: 2082.70 g/mol
• Exact Mass: 2080.74
• IUPAC Name: 2-amino-4,5-dimethoxybenzamide;2-amino-4,5-dimethoxybenzoic acid;N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-4-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-4-ylquinazoline;6,7-dimethoxy-2-pyridin-4-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-4-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;pyridine-4-carboxylic acid;4-[2-(sulfamoylamino)ethyl]piperidine
• SMILES: COc1cc(N)c(C(=O)O)cc1OC.COc1cc(N)c(C(N)=O)cc1OC.COc1cc(NC(=O)c2ccncc2)c(C(N)=O)cc1OC.COc1cc2nc(-c3ccncc3)[nH]c(=O)c2cc1OC.COc1cc2nc(-c3ccncc3)nc(Cl)c2cc1OC.COc1cc2nc(-c3ccncc3)nc(N3CCC(CCNS(N)(=O)=O)CC3)c2cc1OC.NS(=O)(=O)NCCC1CCNCC1.O=C(O)c1ccncc1
• InChI: InChI=1S/C22H28N6O4S.C15H12ClN3O2.C15H15N3O4.C15H13N3O3.C9H12N2O3.C9H11NO4.C7H17N3O2S.C6H5NO2/c1-31-19-13-17-18(14-20(19)32-2)26-21(16-4-8-24-9-5-16)27-22(17)28-11-6-15(7-12-28)3-10-25-33(23,29)30;1-20-12-7-10-11(8-13(12)21-2)18-15(19-14(10)16)9-3-5-17-6-4-9;1-21-12-7-10(14(16)19)11(8-13(12)22-2)18-15(20)9-3-5-17-6-4-9;1-20-12-7-10-11(8-13(12)21-2)17-14(18-15(10)19)9-3-5-16-6-4-9;2*1-13-7-3-5(9(11)12)6(10)4-8(7)14-2;8-13(11,12)10-6-3-7-1-4-9-5-2-7;8-6(9)5-1-3-7-4-2-5/h4-5,8-9,13-15,25H,3,6-7,10-12H2,1-2H3,(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);3-4H,10H2,1-2H3,(H2,11,12);3-4H,10H2,1-2H3,(H,11,12);7,9-10H,1-6H2,(H2,8,11,12);1-4H,(H,8,9)
• InChIKey: YWPWQXKUVNRIKA-UHFFFAOYSA-N
• XLogP: 10.24
• TPSA: 674.09 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 36
• Rotatable Bonds: 30
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2082.70
LogP ≤ 5	10.24
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

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

Frequently Asked Questions

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

The IUPAC name of 2-amino-4,5-dimethoxybenzamide;2-amino-4,5-dimethoxybenzoic acid;N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-4-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-4-ylquinazoline;6,7-dimethoxy-2-pyridin-4-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-4-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;pyridine-4-carboxylic acid;4-[2-(sulfamoylamino)ethyl]piperidine (CID 162035795) is 2-amino-4,5-dimethoxybenzamide;2-amino-4,5-dimethoxybenzoic acid;N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-4-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-4-ylquinazoline;6,7-dimethoxy-2-pyridin-4-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-4-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;pyridine-4-carboxylic acid;4-[2-(sulfamoylamino)ethyl]piperidine.

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

The canonical SMILES for 2-amino-4,5-dimethoxybenzamide;2-amino-4,5-dimethoxybenzoic acid;N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-4-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-4-ylquinazoline;6,7-dimethoxy-2-pyridin-4-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-4-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;pyridine-4-carboxylic acid;4-[2-(sulfamoylamino)ethyl]piperidine is COc1cc(N)c(C(=O)O)cc1OC.COc1cc(N)c(C(N)=O)cc1OC.COc1cc(NC(=O)c2ccncc2)c(C(N)=O)cc1OC.COc1cc2nc(-c3ccncc3)[nH]c(=O)c2cc1OC.COc1cc2nc(-c3ccncc3)nc(Cl)c2cc1OC.COc1cc2nc(-c3ccncc3)nc(N3CCC(CCNS(N)(=O)=O)CC3)c2cc1OC.NS(=O)(=O)NCCC1CCNCC1.O=C(O)c1ccncc1.

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

The InChIKey is YWPWQXKUVNRIKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N6O4S.C15H12ClN3O2.C15H15N3O4.C15H13N3O3.C9H12N2O3.C9H11NO4.C7H17N3O2S.C6H5NO2/c1-31-19-13-17-18(14-20(19)32-2)26-21(16-4-8-24-9-5-16)27-22(17)28-11-6-15(7-12-28)3-10-25-33(23,29)30;1-20-12-7-10-11(8-13(12)21-2)18-15(19-14(10)16)9-3-5-17-6-4-9;1-21-12-7-10(14(16)19)11(8-13(12)22-2)18-15(20)9-3-5-17-6-4-9;1-20-12-7-10-11(8-13(12)21-2)17-14(18-15(10)19)9-3-5-16-6-4-9;2*1-13-7-3-5(9(11)12)6(10)4-8(7)14-2;8-13(11,12)10-6-3-7-1-4-9-5-2-7;8-6(9)5-1-3-7-4-2-5/h4-5,8-9,13-15,25H,3,6-7,10-12H2,1-2H3,(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);3-4H,10H2,1-2H3,(H2,11,12);3-4H,10H2,1-2H3,(H,11,12);7,9-10H,1-6H2,(H2,8,11,12);1-4H,(H,8,9).

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

2-amino-4,5-dimethoxybenzamide;2-amino-4,5-dimethoxybenzoic acid;N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-4-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-4-ylquinazoline;6,7-dimethoxy-2-pyridin-4-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-4-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;pyridine-4-carboxylic acid;4-[2-(sulfamoylamino)ethyl]piperidine has a molecular weight of 2082.70 g/mol, XLogP of 10.24, 30 rotatable bonds, 13 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-4,5-dimethoxybenzamide;2-amino-4,5-dimethoxybenzoic acid;N-(2-carbamoyl-4,5-dimethoxyphenyl)pyridine-4-carboxamide;4-chloro-6,7-dimethoxy-2-pyridin-4-ylquinazoline;6,7-dimethoxy-2-pyridin-4-yl-3H-quinazolin-4-one;6,7-dimethoxy-2-pyridin-4-yl-4-[4-[2-(sulfamoylamino)ethyl]piperidin-1-yl]quinazoline;pyridine-4-carboxylic acid;4-[2-(sulfamoylamino)ethyl]piperidine is sourced from PubChem (CID 162035795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).