2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide)

C91H94Cl5N19O13S3 — CID 158323137

About 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide)

2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide) (PubChem CID 158323137) has the molecular formula C91H94Cl5N19O13S3 and a molecular weight of 1935.34 g/mol. Its IUPAC name is 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide).

Molecular Properties

• Compound Name: 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide)
• PubChem CID: 158323137
• Molecular Formula: C91H94Cl5N19O13S3
• Molecular Weight: 1935.34 g/mol
• Exact Mass: 1931.49
• IUPAC Name: 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide)
• SMILES: CC(C)(O)c1ccc(N)nc1.Cc1cccnc1N.Cc1cccnc1Nc1cc(Cl)ncc1C(=O)C1CC1.Cc1cccnc1Nc1cc(Cl)ncc1C(=O)C1CC1.Cc1cccnc1Nc1cc(Cl)ncc1C(=O)C1CC1.Cc1cccnc1Nc1cc(Nc2ccc(C(C)(C)O)cn2)ncc1C(=O)C1CC1.O=C(c1cnc(Cl)cc1Cl)C1CC1.O=S=O.O=S=O.O=S=O
• InChI: InChI=1S/C23H25N5O2.3C15H14ClN3O.C9H7Cl2NO.C8H12N2O.C6H8N2.3O2S/c1-14-5-4-10-24-22(14)27-18-11-20(26-13-17(18)21(29)15-6-7-15)28-19-9-8-16(12-25-19)23(2,3)30;3*1-9-3-2-6-17-15(9)19-12-7-13(16)18-8-11(12)14(20)10-4-5-10;10-7-3-8(11)12-4-6(7)9(13)5-1-2-5;1-8(2,11)6-3-4-7(9)10-5-6;1-5-3-2-4-8-6(5)7;3*1-3-2/h4-5,8-13,15,30H,6-7H2,1-3H3,(H2,24,25,26,27,28);3*2-3,6-8,10H,4-5H2,1H3,(H,17,18,19);3-5H,1-2H2;3-5,11H,1-2H3,(H2,9,10);2-4H,1H3,(H2,7,8)
• InChIKey: GPCAJXDDSYPUFB-UHFFFAOYSA-N
• XLogP: 18.65
• TPSA: 495.10 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 32
• Rotatable Bonds: 22
• Heavy Atoms: 131
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1935.34
LogP ≤ 5	18.65
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide)?

The IUPAC name of 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide) (CID 158323137) is 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide).

What is the SMILES notation for 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide)?

The canonical SMILES for 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide) is CC(C)(O)c1ccc(N)nc1.Cc1cccnc1N.Cc1cccnc1Nc1cc(Cl)ncc1C(=O)C1CC1.Cc1cccnc1Nc1cc(Cl)ncc1C(=O)C1CC1.Cc1cccnc1Nc1cc(Cl)ncc1C(=O)C1CC1.Cc1cccnc1Nc1cc(Nc2ccc(C(C)(C)O)cn2)ncc1C(=O)C1CC1.O=C(c1cnc(Cl)cc1Cl)C1CC1.O=S=O.O=S=O.O=S=O.

What is the InChIKey of 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide)?

The InChIKey is GPCAJXDDSYPUFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N5O2.3C15H14ClN3O.C9H7Cl2NO.C8H12N2O.C6H8N2.3O2S/c1-14-5-4-10-24-22(14)27-18-11-20(26-13-17(18)21(29)15-6-7-15)28-19-9-8-16(12-25-19)23(2,3)30;3*1-9-3-2-6-17-15(9)19-12-7-13(16)18-8-11(12)14(20)10-4-5-10;10-7-3-8(11)12-4-6(7)9(13)5-1-2-5;1-8(2,11)6-3-4-7(9)10-5-6;1-5-3-2-4-8-6(5)7;3*1-3-2/h4-5,8-13,15,30H,6-7H2,1-3H3,(H2,24,25,26,27,28);3*2-3,6-8,10H,4-5H2,1H3,(H,17,18,19);3-5H,1-2H2;3-5,11H,1-2H3,(H2,9,10);2-4H,1H3,(H2,7,8);;;.

What are the key properties of 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide)?

2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide) has a molecular weight of 1935.34 g/mol, XLogP of 18.65, 22 rotatable bonds, 9 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(6-amino-3-pyridinyl)propan-2-ol;tris([6-chloro-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]-cyclopropylmethanone);cyclopropyl-(4,6-dichloro-3-pyridinyl)methanone;cyclopropyl-[6-[[5-(2-hydroxypropan-2-yl)-2-pyridinyl]amino]-4-[(3-methyl-2-pyridinyl)amino]-3-pyridinyl]methanone;3-methylpyridin-2-amine;tris(sulfur dioxide) is sourced from PubChem (CID 158323137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).