(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine

C234H228F23N7P14 — CID 161088523

About (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine

(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine (PubChem CID 161088523) has the molecular formula C234H228F23N7P14 and a molecular weight of 4009.04 g/mol. Its IUPAC name is (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine.

Molecular Properties

• Compound Name: (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine
• PubChem CID: 161088523
• Molecular Formula: C234H228F23N7P14
• Molecular Weight: 4009.04 g/mol
• Exact Mass: 4006.40
• IUPAC Name: (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine
• SMILES: Cc1ccc(F)c(P(c2cc(F)ccc2F)N(C2CCC2)P2[C@H](c3ccccc3)CC[C@H]2c2ccccc2)c1.Fc1ccc(F)c(P(c2cc(F)ccc2F)N(C2CCCCC2)P2[C@H](c3ccccc3)CC[C@H]2c2ccccc2)c1.Fc1ccc(P(c2ccc(F)cc2F)N(C2CCCCC2)P2[C@H](c3ccccc3)CC[C@H]2c2ccccc2)c(F)c1.Fc1cccc(P(c2cccc(F)c2F)N(C2CCC2)P2[C@H](c3ccccc3)CC[C@H]2c2ccccc2)c1F.Fc1cccc(P(c2cccc(F)c2F)N(C2CCCCC2)P2[C@H](c3ccccc3)CC[C@H]2c2ccccc2)c1F.Fc1ccccc1P(c1ccccc1F)N(C1CCCC1)P1[C@H](c2ccccc2)CC[C@H]1c1ccccc1.Fc1ccccc1P(c1ccccc1F)N(C1CCCCC1)P1[C@H](c2ccccc2)CC[C@H]1c1ccccc1
• InChI: InChI=1S/3C34H33F4NP2.C34H35F2NP2.C33H32F3NP2.C33H33F2NP2.C32H29F4NP2/c35-27-18-10-20-31(33(27)37)41(32-21-11-19-28(36)34(32)38)39(26-16-8-3-9-17-26)40-29(24-12-4-1-5-13-24)22-23-30(40)25-14-6-2-7-15-25;35-26-16-18-33(29(37)22-26)41(34-19-17-27(36)23-30(34)38)39(28-14-8-3-9-15-28)40-31(24-10-4-1-5-11-24)20-21-32(40)25-12-6-2-7-13-25;35-26-16-18-29(37)33(22-26)41(34-23-27(36)17-19-30(34)38)39(28-14-8-3-9-15-28)40-31(24-10-4-1-5-11-24)20-21-32(40)25-12-6-2-7-13-25;35-29-20-10-12-22-33(29)39(34-23-13-11-21-30(34)36)37(28-18-8-3-9-19-28)38-31(26-14-4-1-5-15-26)24-25-32(38)27-16-6-2-7-17-27;1-23-15-17-28(35)32(21-23)39(33-22-26(34)16-18-29(33)36)37(27-13-8-14-27)38-30(24-9-4-2-5-10-24)19-20-31(38)25-11-6-3-7-12-25;34-28-19-9-11-21-32(28)38(33-22-12-10-20-29(33)35)36(27-17-7-8-18-27)37-30(25-13-3-1-4-14-25)23-24-31(37)26-15-5-2-6-16-26;33-25-16-8-18-29(31(25)35)39(30-19-9-17-26(34)32(30)36)37(24-14-7-15-24)38-27(22-10-3-1-4-11-22)20-21-28(38)23-12-5-2-6-13-23/h1-2,4-7,10-15,18-21,26,29-30H,3,8-9,16-17,22-23H2;2*1-2,4-7,10-13,16-19,22-23,28,31-32H,3,8-9,14-15,20-21H2;1-2,4-7,10-17,20-23,28,31-32H,3,8-9,18-19,24-25H2;2-7,9-12,15-18,21-22,27,30-31H,8,13-14,19-20H2,1H3;1-6,9-16,19-22,27,30-31H,7-8,17-18,23-24H2;1-6,8-13,16-19,24,27-28H,7,14-15,20-21H2/t29-,30-;3*31-,32-;30-,31-,39?;30-,31-;27-,28-/m0000000/s1
• InChIKey: UGVVXLXUMCHDDN-NWWHDOLKSA-N
• XLogP: 66.95
• TPSA: 22.68 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 49
• Heavy Atoms: 278
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	4009.04
LogP ≤ 5	66.95
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine?

The IUPAC name of (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine (CID 161088523) is (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine.

What is the SMILES notation for (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine?

The canonical SMILES for (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine is Cc1ccc(F)c(P(c2cc(F)ccc2F)N(C2CCC2)P2[C@H](c3ccccc3)CC[C@H]2c2ccccc2)c1.Fc1ccc(F)c(P(c2cc(F)ccc2F)N(C2CCCCC2)P2[C@H](c3ccccc3)CC[C@H]2c2ccccc2)c1.Fc1ccc(P(c2ccc(F)cc2F)N(C2CCCCC2)P2[C@H](c3ccccc3)CC[C@H]2c2ccccc2)c(F)c1.Fc1cccc(P(c2cccc(F)c2F)N(C2CCC2)P2[C@H](c3ccccc3)CC[C@H]2c2ccccc2)c1F.Fc1cccc(P(c2cccc(F)c2F)N(C2CCCCC2)P2[C@H](c3ccccc3)CC[C@H]2c2ccccc2)c1F.Fc1ccccc1P(c1ccccc1F)N(C1CCCC1)P1[C@H](c2ccccc2)CC[C@H]1c1ccccc1.Fc1ccccc1P(c1ccccc1F)N(C1CCCCC1)P1[C@H](c2ccccc2)CC[C@H]1c1ccccc1.

What is the InChIKey of (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine?

The InChIKey is UGVVXLXUMCHDDN-NWWHDOLKSA-N. The full InChI is InChI=1S/3C34H33F4NP2.C34H35F2NP2.C33H32F3NP2.C33H33F2NP2.C32H29F4NP2/c35-27-18-10-20-31(33(27)37)41(32-21-11-19-28(36)34(32)38)39(26-16-8-3-9-17-26)40-29(24-12-4-1-5-13-24)22-23-30(40)25-14-6-2-7-15-25;35-26-16-18-33(29(37)22-26)41(34-19-17-27(36)23-30(34)38)39(28-14-8-3-9-15-28)40-31(24-10-4-1-5-11-24)20-21-32(40)25-12-6-2-7-13-25;35-26-16-18-29(37)33(22-26)41(34-23-27(36)17-19-30(34)38)39(28-14-8-3-9-15-28)40-31(24-10-4-1-5-11-24)20-21-32(40)25-12-6-2-7-13-25;35-29-20-10-12-22-33(29)39(34-23-13-11-21-30(34)36)37(28-18-8-3-9-19-28)38-31(26-14-4-1-5-15-26)24-25-32(38)27-16-6-2-7-17-27;1-23-15-17-28(35)32(21-23)39(33-22-26(34)16-18-29(33)36)37(27-13-8-14-27)38-30(24-9-4-2-5-10-24)19-20-31(38)25-11-6-3-7-12-25;34-28-19-9-11-21-32(28)38(33-22-12-10-20-29(33)35)36(27-17-7-8-18-27)37-30(25-13-3-1-4-14-25)23-24-31(37)26-15-5-2-6-16-26;33-25-16-8-18-29(31(25)35)39(30-19-9-17-26(34)32(30)36)37(24-14-7-15-24)38-27(22-10-3-1-4-11-22)20-21-28(38)23-12-5-2-6-13-23/h1-2,4-7,10-15,18-21,26,29-30H,3,8-9,16-17,22-23H2;2*1-2,4-7,10-13,16-19,22-23,28,31-32H,3,8-9,14-15,20-21H2;1-2,4-7,10-17,20-23,28,31-32H,3,8-9,18-19,24-25H2;2-7,9-12,15-18,21-22,27,30-31H,8,13-14,19-20H2,1H3;1-6,9-16,19-22,27,30-31H,7-8,17-18,23-24H2;1-6,8-13,16-19,24,27-28H,7,14-15,20-21H2/t29-,30-;3*31-,32-;30-,31-,39?;30-,31-;27-,28-/m0000000/s1.

What are the key properties of (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine?

(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine has a molecular weight of 4009.04 g/mol, XLogP of 66.95, 49 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for (2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclobutyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,3-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,4-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2,5-difluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclohexyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-bis(2-fluorophenyl)phosphanyl-N-cyclopentyl-2,5-diphenylphospholan-1-amine;(2S,5S)-N-cyclobutyl-N-[(2,5-difluorophenyl)-(2-fluoro-5-methylphenyl)phosphanyl]-2,5-diphenylphospholan-1-amine is sourced from PubChem (CID 161088523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).