2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C89H102Cl6N40O5 — CID 159470757

About 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 159470757) has the molecular formula C89H102Cl6N40O5 and a molecular weight of 2024.79 g/mol. Its IUPAC name is 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

• Compound Name: 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
• PubChem CID: 159470757
• Molecular Formula: C89H102Cl6N40O5
• Molecular Weight: 2024.79 g/mol
• Exact Mass: 2020.71
• IUPAC Name: 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
• SMILES: CC1CN(c2ccncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)CCN1C.CCN1CCN(c2ccncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)CC1.CN1CCN(c2cc(Cl)ncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)CC1.CN1CCN(c2ccncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)CC1(C)C.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCCC(N)C1
• InChI: InChI=1S/C19H23ClN8O.2C18H21ClN8O.C17H18Cl2N8O.C17H19ClN8O/c1-19(2)11-27(7-6-26(19)3)14-4-5-22-9-13(14)24-18(29)15-16(21)25-28-10-12(20)8-23-17(15)28;1-11-9-26(6-5-25(11)2)14-3-4-21-8-13(14)23-18(28)15-16(20)24-27-10-12(19)7-22-17(15)27;1-2-25-5-7-26(8-6-25)14-3-4-21-10-13(14)23-18(28)15-16(20)24-27-11-12(19)9-22-17(15)27;1-25-2-4-26(5-3-25)12-6-13(19)21-8-11(12)23-17(28)14-15(20)24-27-9-10(18)7-22-16(14)27;18-10-6-22-16-14(15(20)24-26(16)8-10)17(27)23-12-7-21-4-3-13(12)25-5-1-2-11(19)9-25/h4-5,8-10H,6-7,11H2,1-3H3,(H2,21,25)(H,24,29);3-4,7-8,10-11H,5-6,9H2,1-2H3,(H2,20,24)(H,23,28);3-4,9-11H,2,5-8H2,1H3,(H2,20,24)(H,23,28);6-9H,2-5H2,1H3,(H2,20,24)(H,23,28);3-4,6-8,11H,1-2,5,9,19H2,(H2,20,24)(H,23,27)
• InChIKey: LVTQLZVCIRBIOD-UHFFFAOYSA-N
• XLogP: 9.21
• TPSA: 546.18 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 40
• Rotatable Bonds: 16
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2024.79
LogP ≤ 5	9.21
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The IUPAC name of 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 159470757) is 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

What is the SMILES notation for 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The canonical SMILES for 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is CC1CN(c2ccncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)CCN1C.CCN1CCN(c2ccncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)CC1.CN1CCN(c2cc(Cl)ncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)CC1.CN1CCN(c2ccncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)CC1(C)C.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1N1CCCC(N)C1.

What is the InChIKey of 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The InChIKey is LVTQLZVCIRBIOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN8O.2C18H21ClN8O.C17H18Cl2N8O.C17H19ClN8O/c1-19(2)11-27(7-6-26(19)3)14-4-5-22-9-13(14)24-18(29)15-16(21)25-28-10-12(20)8-23-17(15)28;1-11-9-26(6-5-25(11)2)14-3-4-21-8-13(14)23-18(28)15-16(20)24-27-10-12(19)7-22-17(15)27;1-2-25-5-7-26(8-6-25)14-3-4-21-10-13(14)23-18(28)15-16(20)24-27-11-12(19)9-22-17(15)27;1-25-2-4-26(5-3-25)12-6-13(19)21-8-11(12)23-17(28)14-15(20)24-27-9-10(18)7-22-16(14)27;18-10-6-22-16-14(15(20)24-26(16)8-10)17(27)23-12-7-21-4-3-13(12)25-5-1-2-11(19)9-25/h4-5,8-10H,6-7,11H2,1-3H3,(H2,21,25)(H,24,29);3-4,7-8,10-11H,5-6,9H2,1-2H3,(H2,20,24)(H,23,28);3-4,9-11H,2,5-8H2,1H3,(H2,20,24)(H,23,28);6-9H,2-5H2,1H3,(H2,20,24)(H,23,28);3-4,6-8,11H,1-2,5,9,19H2,(H2,20,24)(H,23,27).

What are the key properties of 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 2024.79 g/mol, XLogP of 9.21, 16 rotatable bonds, 11 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[6-chloro-4-(4-methylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-(3,3,4-trimethylpiperazin-1-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 159470757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).