1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride

C75H78Cl6F3N25O2S — CID 159237415

About 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride

1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride (PubChem CID 159237415) has the molecular formula C75H78Cl6F3N25O2S and a molecular weight of 1663.40 g/mol. Its IUPAC name is 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride.

Molecular Properties

• Compound Name: 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride
• PubChem CID: 159237415
• Molecular Formula: C75H78Cl6F3N25O2S
• Molecular Weight: 1663.40 g/mol
• Exact Mass: 1659.46
• IUPAC Name: 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride
• SMILES: CC1CN(c2ccnc(N)n2)c2ccccc21.CC1Cc2cc(Cl)ccc2N1c1ccnc(N)n1.CC1Cc2cc(F)ccc2N1c1ccnc(N)n1.Cl.Cl.Cl.Cl.Cl.Nc1nccc(-n2ccc3ccc(F)cc32)n1.Nc1nccc(N2CCc3cc(S(N)(=O)=O)ccc32)n1.Nc1nccc(N2CCc3ccc(F)cc32)n1
• InChI: InChI=1S/C13H13ClN4.C13H13FN4.C13H14N4.C12H11FN4.C12H9FN4.C12H13N5O2S.5ClH/c2*1-8-6-9-7-10(14)2-3-11(9)18(8)12-4-5-16-13(15)17-12;1-9-8-17(11-5-3-2-4-10(9)11)12-6-7-15-13(14)16-12;2*13-9-2-1-8-4-6-17(10(8)7-9)11-3-5-15-12(14)16-11;13-12-15-5-3-11(16-12)17-6-4-8-7-9(20(14,18)19)1-2-10(8)17;;;;;/h2*2-5,7-8H,6H2,1H3,(H2,15,16,17);2-7,9H,8H2,1H3,(H2,14,15,16);1-3,5,7H,4,6H2,(H2,14,15,16);1-7H,(H2,14,15,16);1-3,5,7H,4,6H2,(H2,13,15,16)(H2,14,18,19);5*1H
• InChIKey: AYRJBWQCDHGCSU-UHFFFAOYSA-N
• XLogP: 13.93
• TPSA: 392.09 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 26
• Rotatable Bonds: 7
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1663.40
LogP ≤ 5	13.93
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride?

The IUPAC name of 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride (CID 159237415) is 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride.

What is the SMILES notation for 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride?

The canonical SMILES for 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride is CC1CN(c2ccnc(N)n2)c2ccccc21.CC1Cc2cc(Cl)ccc2N1c1ccnc(N)n1.CC1Cc2cc(F)ccc2N1c1ccnc(N)n1.Cl.Cl.Cl.Cl.Cl.Nc1nccc(-n2ccc3ccc(F)cc32)n1.Nc1nccc(N2CCc3cc(S(N)(=O)=O)ccc32)n1.Nc1nccc(N2CCc3ccc(F)cc32)n1.

What is the InChIKey of 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride?

The InChIKey is AYRJBWQCDHGCSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN4.C13H13FN4.C13H14N4.C12H11FN4.C12H9FN4.C12H13N5O2S.5ClH/c2*1-8-6-9-7-10(14)2-3-11(9)18(8)12-4-5-16-13(15)17-12;1-9-8-17(11-5-3-2-4-10(9)11)12-6-7-15-13(14)16-12;2*13-9-2-1-8-4-6-17(10(8)7-9)11-3-5-15-12(14)16-11;13-12-15-5-3-11(16-12)17-6-4-8-7-9(20(14,18)19)1-2-10(8)17;;;;;/h2*2-5,7-8H,6H2,1H3,(H2,15,16,17);2-7,9H,8H2,1H3,(H2,14,15,16);1-3,5,7H,4,6H2,(H2,14,15,16);1-7H,(H2,14,15,16);1-3,5,7H,4,6H2,(H2,13,15,16)(H2,14,18,19);5*1H.

What are the key properties of 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride?

1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride has a molecular weight of 1663.40 g/mol, XLogP of 13.93, 7 rotatable bonds, 7 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(2-aminopyrimidin-4-yl)-2,3-dihydroindole-5-sulfonamide;4-(5-chloro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(6-fluoroindol-1-yl)pyrimidin-2-amine;4-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;4-(3-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine;pentahydrochloride is sourced from PubChem (CID 159237415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).