3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine

C103H118Cl4F10N8O21 — CID 157214020

About 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine

3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine (PubChem CID 157214020) has the molecular formula C103H118Cl4F10N8O21 and a molecular weight of 2135.90 g/mol. Its IUPAC name is 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine.

Molecular Properties

• Compound Name: 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine
• PubChem CID: 157214020
• Molecular Formula: C103H118Cl4F10N8O21
• Molecular Weight: 2135.90 g/mol
• Exact Mass: 2132.70
• IUPAC Name: 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine
• SMILES: CC(O)(CO)c1cc2c(c(Cl)n1)OC[C@]2(C)C1CC1.CC1(c2cc3c(c(Cl)n2)OC[C@]3(C)C2CC2)CO1.COc1cc(C(=O)CCC(O)(c2cc3c(c(-c4ccc(F)cc4)n2)OC[C@]3(N)C2CC2)C(F)(F)F)ccc1OC[C@@H](C)O.COc1cc(C(=O)CCC(O)(c2cc3c(c(Cl)n2)OCC3(NC(=O)OC(C)(C)C)C2CC2)C(F)(F)F)ccc1OC[C@@H](C)O.C[C@]1(C2CC2)COc2c1cc(C(O)(CN)C(F)(F)F)nc2Cl
• InChI: InChI=1S/C31H32F4N2O6.C30H36ClF3N2O8.C14H16ClF3N2O2.C14H18ClNO3.C14H16ClNO2/c1-17(38)15-42-24-10-5-19(13-25(24)41-2)23(39)11-12-30(40,31(33,34)35)26-14-22-28(43-16-29(22,36)20-6-7-20)27(37-26)18-3-8-21(32)9-4-18;1-16(37)14-42-21-9-6-17(12-22(21)41-5)20(38)10-11-29(40,30(32,33)34)23-13-19-24(25(31)35-23)43-15-28(19,18-7-8-18)36-26(39)44-27(2,3)4;1-12(7-2-3-7)6-22-10-8(12)4-9(20-11(10)15)13(21,5-19)14(16,17)18;1-13(8-3-4-8)7-19-11-9(13)5-10(16-12(11)15)14(2,18)6-17;1-13(8-3-4-8)6-17-11-9(13)5-10(16-12(11)15)14(2)7-18-14/h3-5,8-10,13-14,17,20,38,40H,6-7,11-12,15-16,36H2,1-2H3;6,9,12-13,16,18,37,40H,7-8,10-11,14-15H2,1-5H3,(H,36,39);4,7,21H,2-3,5-6,19H2,1H3;5,8,17-18H,3-4,6-7H2,1-2H3;5,8H,3-4,6-7H2,1-2H3/t17-,29+,30?;16-,28?,29?;12-,13?;2*13-,14?/m11111/s1
• InChIKey: ASFAYJXHMRFGPC-VZWAHVEOSA-N
• XLogP: 18.00
• TPSA: 426.17 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 28
• Rotatable Bonds: 30
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2135.90
LogP ≤ 5	18.00
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine?

The IUPAC name of 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine (CID 157214020) is 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine.

What is the SMILES notation for 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine?

The canonical SMILES for 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine is CC(O)(CO)c1cc2c(c(Cl)n1)OC[C@]2(C)C1CC1.CC1(c2cc3c(c(Cl)n2)OC[C@]3(C)C2CC2)CO1.COc1cc(C(=O)CCC(O)(c2cc3c(c(-c4ccc(F)cc4)n2)OC[C@]3(N)C2CC2)C(F)(F)F)ccc1OC[C@@H](C)O.COc1cc(C(=O)CCC(O)(c2cc3c(c(Cl)n2)OCC3(NC(=O)OC(C)(C)C)C2CC2)C(F)(F)F)ccc1OC[C@@H](C)O.C[C@]1(C2CC2)COc2c1cc(C(O)(CN)C(F)(F)F)nc2Cl.

What is the InChIKey of 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine?

The InChIKey is ASFAYJXHMRFGPC-VZWAHVEOSA-N. The full InChI is InChI=1S/C31H32F4N2O6.C30H36ClF3N2O8.C14H16ClF3N2O2.C14H18ClNO3.C14H16ClNO2/c1-17(38)15-42-24-10-5-19(13-25(24)41-2)23(39)11-12-30(40,31(33,34)35)26-14-22-28(43-16-29(22,36)20-6-7-20)27(37-26)18-3-8-21(32)9-4-18;1-16(37)14-42-21-9-6-17(12-22(21)41-5)20(38)10-11-29(40,30(32,33)34)23-13-19-24(25(31)35-23)43-15-28(19,18-7-8-18)36-26(39)44-27(2,3)4;1-12(7-2-3-7)6-22-10-8(12)4-9(20-11(10)15)13(21,5-19)14(16,17)18;1-13(8-3-4-8)7-19-11-9(13)5-10(16-12(11)15)14(2,18)6-17;1-13(8-3-4-8)6-17-11-9(13)5-10(16-12(11)15)14(2)7-18-14/h3-5,8-10,13-14,17,20,38,40H,6-7,11-12,15-16,36H2,1-2H3;6,9,12-13,16,18,37,40H,7-8,10-11,14-15H2,1-5H3,(H,36,39);4,7,21H,2-3,5-6,19H2,1H3;5,8,17-18H,3-4,6-7H2,1-2H3;5,8H,3-4,6-7H2,1-2H3/t17-,29+,30?;16-,28?,29?;12-,13?;2*13-,14?/m11111/s1.

What are the key properties of 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine?

3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine has a molecular weight of 2135.90 g/mol, XLogP of 18.00, 30 rotatable bonds, 10 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 3-amino-2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1,1,1-trifluoropropan-2-ol;4-[(3S)-3-amino-3-cyclopropyl-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;tert-butyl N-[7-chloro-3-cyclopropyl-5-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-2H-furo[2,3-c]pyridin-3-yl]carbamate;2-[(3R)-7-chloro-3-cyclopropyl-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propane-1,2-diol;(3R)-7-chloro-3-cyclopropyl-3-methyl-5-(2-methyloxiran-2-yl)-2H-furo[2,3-c]pyridine is sourced from PubChem (CID 157214020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).