2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile

C165H203F8N19O4 — CID 158851299

IUPAC2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile
SMILESCC(C)(C)C1(CC#N)CCN(Cc2cc(O)c(-c3ccccc3)cc2F)CC1F.CC(C)(C)C1(CC#N)CCN(Cc2ccc(-c3ccccc3)cc2O)CC1.CC(C)(C)C1(CC#N)CCN(Cc2ccc(-c3ccccc3)nc2F)CC1F.CC(C)(C)C1(CC#N)CCN(Cc2ccc(-n3nccn3)cc2)CC1F.CC(C)(C)C1(CC#N)CCN(Cc2cnc(-c3ccccc3)cc2F)CC1.CCc1ccc(-c2ccc(CN3CCC(CC#N)(C(C)(C)C)C(F)C3)cc2O)cc1.Cc1c(CN2CCC(CC#N)(C(C)(C)C)C(F)C2)ccc(-c2ccccc2)c1O
InChIInChI=1S/C26H33FN2O.C25H31FN2O.C24H28F2N2O.C24H30N2O.C23H27F2N3.C23H28FN3.C20H26FN5/c1-5-19-6-9-21(10-7-19)22-11-8-20(16-23(22)30)17-29-15-13-26(12-14-28,24(27)18-29)25(2,3)4;1-18-20(10-11-21(23(18)29)19-8-6-5-7-9-19)16-28-15-13-25(12-14-27,22(26)17-28)24(2,3)4;1-23(2,3)24(9-11-27)10-12-28(16-22(24)26)15-18-13-21(29)19(14-20(18)25)17-7-5-4-6-8-17;1-23(2,3)24(11-14-25)12-15-26(16-13-24)18-21-10-9-20(17-22(21)27)19-7-5-4-6-8-19;1-22(2,3)23(11-13-26)12-14-28(16-20(23)24)15-18-9-10-19(27-21(18)25)17-7-5-4-6-8-17;1-22(2,3)23(9-12-25)10-13-27(14-11-23)17-19-16-26-21(15-20(19)24)18-7-5-4-6-8-18;1-19(2,3)20(8-10-22)9-13-25(15-18(20)21)14-16-4-6-17(7-5-16)26-23-11-12-24-26/h6-11,16,24,30H,5,12-13,15,17-18H2,1-4H3;5-11,22,29H,12-13,15-17H2,1-4H3;4-8,13-14,22,29H,9-10,12,15-16H2,1-3H3;4-10,17,27H,11-13,15-16,18H2,1-3H3;4-10,20H,11-12,14-16H2,1-3H3;4-8,15-16H,9-11,13-14,17H2,1-3H3;4-7,11-12,18H,8-9,13-15H2,1-3H3
InChIKeyIZMFFAYKVNGEAY-UHFFFAOYSA-N
MW2668.55 g/mol
LogP37.82
Rot. Bonds29

About 2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile

2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile (PubChem CID 158851299) has the molecular formula C165H203F8N19O4 and a molecular weight of 2668.55 g/mol. Its IUPAC name is 2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile.

Molecular Properties

Compound Name2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile
PubChem CID158851299
Molecular FormulaC165H203F8N19O4
Molecular Weight2668.55 g/mol
Exact Mass2666.61
IUPAC Name2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile
SMILESCC(C)(C)C1(CC#N)CCN(Cc2cc(O)c(-c3ccccc3)cc2F)CC1F.CC(C)(C)C1(CC#N)CCN(Cc2ccc(-c3ccccc3)cc2O)CC1.CC(C)(C)C1(CC#N)CCN(Cc2ccc(-c3ccccc3)nc2F)CC1F.CC(C)(C)C1(CC#N)CCN(Cc2ccc(-n3nccn3)cc2)CC1F.CC(C)(C)C1(CC#N)CCN(Cc2cnc(-c3ccccc3)cc2F)CC1.CCc1ccc(-c2ccc(CN3CCC(CC#N)(C(C)(C)C)C(F)C3)cc2O)cc1.Cc1c(CN2CCC(CC#N)(C(C)(C)C)C(F)C2)ccc(-c2ccccc2)c1O
InChIInChI=1S/C26H33FN2O.C25H31FN2O.C24H28F2N2O.C24H30N2O.C23H27F2N3.C23H28FN3.C20H26FN5/c1-5-19-6-9-21(10-7-19)22-11-8-20(16-23(22)30)17-29-15-13-26(12-14-28,24(27)18-29)25(2,3)4;1-18-20(10-11-21(23(18)29)19-8-6-5-7-9-19)16-28-15-13-25(12-14-27,22(26)17-28)24(2,3)4;1-23(2,3)24(9-11-27)10-12-28(16-22(24)26)15-18-13-21(29)19(14-20(18)25)17-7-5-4-6-8-17;1-23(2,3)24(11-14-25)12-15-26(16-13-24)18-21-10-9-20(17-22(21)27)19-7-5-4-6-8-19;1-22(2,3)23(11-13-26)12-14-28(16-20(23)24)15-18-9-10-19(27-21(18)25)17-7-5-4-6-8-17;1-22(2,3)23(9-12-25)10-13-27(14-11-23)17-19-16-26-21(15-20(19)24)18-7-5-4-6-8-18;1-19(2,3)20(8-10-22)9-13-25(15-18(20)21)14-16-4-6-17(7-5-16)26-23-11-12-24-26/h6-11,16,24,30H,5,12-13,15,17-18H2,1-4H3;5-11,22,29H,12-13,15-17H2,1-4H3;4-8,13-14,22,29H,9-10,12,15-16H2,1-3H3;4-10,17,27H,11-13,15-16,18H2,1-3H3;4-10,20H,11-12,14-16H2,1-3H3;4-8,15-16H,9-11,13-14,17H2,1-3H3;4-7,11-12,18H,8-9,13-15H2,1-3H3
InChIKeyIZMFFAYKVNGEAY-UHFFFAOYSA-N
XLogP37.82
TPSA326.62 Ų
H-Bond Donors4
H-Bond Acceptors23
Rotatable Bonds29
Heavy Atoms196
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002668.55
LogP ≤ 537.82
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile?
The IUPAC name of 2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile (CID 158851299) is 2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile.
What is the SMILES notation for 2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile?
The canonical SMILES for 2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile is CC(C)(C)C1(CC#N)CCN(Cc2cc(O)c(-c3ccccc3)cc2F)CC1F.CC(C)(C)C1(CC#N)CCN(Cc2ccc(-c3ccccc3)cc2O)CC1.CC(C)(C)C1(CC#N)CCN(Cc2ccc(-c3ccccc3)nc2F)CC1F.CC(C)(C)C1(CC#N)CCN(Cc2ccc(-n3nccn3)cc2)CC1F.CC(C)(C)C1(CC#N)CCN(Cc2cnc(-c3ccccc3)cc2F)CC1.CCc1ccc(-c2ccc(CN3CCC(CC#N)(C(C)(C)C)C(F)C3)cc2O)cc1.Cc1c(CN2CCC(CC#N)(C(C)(C)C)C(F)C2)ccc(-c2ccccc2)c1O.
What is the InChIKey of 2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile?
The InChIKey is IZMFFAYKVNGEAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33FN2O.C25H31FN2O.C24H28F2N2O.C24H30N2O.C23H27F2N3.C23H28FN3.C20H26FN5/c1-5-19-6-9-21(10-7-19)22-11-8-20(16-23(22)30)17-29-15-13-26(12-14-28,24(27)18-29)25(2,3)4;1-18-20(10-11-21(23(18)29)19-8-6-5-7-9-19)16-28-15-13-25(12-14-27,22(26)17-28)24(2,3)4;1-23(2,3)24(9-11-27)10-12-28(16-22(24)26)15-18-13-21(29)19(14-20(18)25)17-7-5-4-6-8-17;1-23(2,3)24(11-14-25)12-15-26(16-13-24)18-21-10-9-20(17-22(21)27)19-7-5-4-6-8-19;1-22(2,3)23(11-13-26)12-14-28(16-20(23)24)15-18-9-10-19(27-21(18)25)17-7-5-4-6-8-17;1-22(2,3)23(9-12-25)10-13-27(14-11-23)17-19-16-26-21(15-20(19)24)18-7-5-4-6-8-18;1-19(2,3)20(8-10-22)9-13-25(15-18(20)21)14-16-4-6-17(7-5-16)26-23-11-12-24-26/h6-11,16,24,30H,5,12-13,15,17-18H2,1-4H3;5-11,22,29H,12-13,15-17H2,1-4H3;4-8,13-14,22,29H,9-10,12,15-16H2,1-3H3;4-10,17,27H,11-13,15-16,18H2,1-3H3;4-10,20H,11-12,14-16H2,1-3H3;4-8,15-16H,9-11,13-14,17H2,1-3H3;4-7,11-12,18H,8-9,13-15H2,1-3H3.
What are the key properties of 2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile?
2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile has a molecular weight of 2668.55 g/mol, XLogP of 37.82, 29 rotatable bonds, 4 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-tert-butyl-1-[[4-(4-ethylphenyl)-3-hydroxyphenyl]methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-5-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(2-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[(3-hydroxy-2-methyl-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-fluoro-6-phenyl-3-pyridinyl)methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-3-fluoro-1-[[4-(triazol-2-yl)phenyl]methyl]piperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-hydroxy-4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile is sourced from PubChem (CID 158851299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).