N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane

C154H176N4O5P6 — CID 161459728

About N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane

N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane (PubChem CID 161459728) has the molecular formula C154H176N4O5P6 and a molecular weight of 2348.97 g/mol. Its IUPAC name is N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane.

Molecular Properties

• Compound Name: N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane
• PubChem CID: 161459728
• Molecular Formula: C154H176N4O5P6
• Molecular Weight: 2348.97 g/mol
• Exact Mass: 2347.21
• IUPAC Name: N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane
• SMILES: CPCc1cccc(C)c1Pc1ccccc1OCc1ccccc1.Cc1cc(C(C)(C)C)cc(Pc2c(C)cccc2CNCc2ccccc2)c1OCc1ccccc1.Cc1cc(C)c(OCc2ccccc2)c(Pc2c(C)cccc2CNCc2ccccc2)c1.Cc1cc(Pc2c(C)cccc2CNCc2ccccc2)c(OCc2ccccc2)c(C(C)(C)C)c1.Cc1cccc(CNCc2ccccc2)c1Pc1cc(C(C)(C)C)cc(C(C)(C)C)c1OCc1ccccc1
• InChI: InChI=1S/C36H44NOP.2C33H38NOP.C30H32NOP.C22H24OP2/c1-26-15-14-20-29(24-37-23-27-16-10-8-11-17-27)34(26)39-32-22-30(35(2,3)4)21-31(36(5,6)7)33(32)38-25-28-18-12-9-13-19-28;1-24-19-29(33(3,4)5)31(35-23-27-16-10-7-11-17-27)30(20-24)36-32-25(2)13-12-18-28(32)22-34-21-26-14-8-6-9-15-26;1-24-13-12-18-28(22-34-21-26-14-8-6-9-15-26)32(24)36-30-20-29(33(3,4)5)19-25(2)31(30)35-23-27-16-10-7-11-17-27;1-22-17-24(3)29(32-21-26-14-8-5-9-15-26)28(18-22)33-30-23(2)11-10-16-27(30)20-31-19-25-12-6-4-7-13-25;1-17-9-8-12-19(16-24-2)22(17)25-21-14-7-6-13-20(21)23-15-18-10-4-3-5-11-18/h8-22,37,39H,23-25H2,1-7H3;2*6-20,34,36H,21-23H2,1-5H3;4-18,31,33H,19-21H2,1-3H3;3-14,24-25H,15-16H2,1-2H3
• InChIKey: WBQDYIPVVJKCNA-UHFFFAOYSA-N
• XLogP: 33.41
• TPSA: 94.27 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 9
• Rotatable Bonds: 43
• Heavy Atoms: 169
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2348.97
LogP ≤ 5	33.41
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane?

The IUPAC name of N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane (CID 161459728) is N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane.

What is the SMILES notation for N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane?

The canonical SMILES for N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane is CPCc1cccc(C)c1Pc1ccccc1OCc1ccccc1.Cc1cc(C(C)(C)C)cc(Pc2c(C)cccc2CNCc2ccccc2)c1OCc1ccccc1.Cc1cc(C)c(OCc2ccccc2)c(Pc2c(C)cccc2CNCc2ccccc2)c1.Cc1cc(Pc2c(C)cccc2CNCc2ccccc2)c(OCc2ccccc2)c(C(C)(C)C)c1.Cc1cccc(CNCc2ccccc2)c1Pc1cc(C(C)(C)C)cc(C(C)(C)C)c1OCc1ccccc1.

What is the InChIKey of N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane?

The InChIKey is WBQDYIPVVJKCNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H44NOP.2C33H38NOP.C30H32NOP.C22H24OP2/c1-26-15-14-20-29(24-37-23-27-16-10-8-11-17-27)34(26)39-32-22-30(35(2,3)4)21-31(36(5,6)7)33(32)38-25-28-18-12-9-13-19-28;1-24-19-29(33(3,4)5)31(35-23-27-16-10-7-11-17-27)30(20-24)36-32-25(2)13-12-18-28(32)22-34-21-26-14-8-6-9-15-26;1-24-13-12-18-28(22-34-21-26-14-8-6-9-15-26)32(24)36-30-20-29(33(3,4)5)19-25(2)31(30)35-23-27-16-10-7-11-17-27;1-22-17-24(3)29(32-21-26-14-8-5-9-15-26)28(18-22)33-30-23(2)11-10-16-27(30)20-31-19-25-12-6-4-7-13-25;1-17-9-8-12-19(16-24-2)22(17)25-21-14-7-6-13-20(21)23-15-18-10-4-3-5-11-18/h8-22,37,39H,23-25H2,1-7H3;2*6-20,34,36H,21-23H2,1-5H3;4-18,31,33H,19-21H2,1-3H3;3-14,24-25H,15-16H2,1-2H3.

What are the key properties of N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane?

N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane has a molecular weight of 2348.97 g/mol, XLogP of 33.41, 43 rotatable bonds, 4 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[2-(3-tert-butyl-5-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(5-tert-butyl-3-methyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-ditert-butyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;N-[[2-(3,5-dimethyl-2-phenylmethoxyphenyl)phosphanyl-3-methylphenyl]methyl]-1-phenylmethanamine;methyl-[[3-methyl-2-(2-phenylmethoxyphenyl)phosphanylphenyl]methyl]phosphane is sourced from PubChem (CID 161459728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).