2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile

C135H175Cl2F10N17O4 — CID 160711866

IUPAC2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile
SMILESC#Cc1ccc(CN2CCC(CC#N)(C(C)(C)C)C(F)C2)c(Cl)c1.C=C(C)c1cc(F)c(CN2CCC(CC#N)(C(C)C)C(F)C2)cc1O.C=Cc1ccc(CN2CCC(CC#N)(C(C)(C)C)C(F)C2)cc1O.CC(C)(C)C1(CC#N)CCN(Cc2cc(O)ccc2Cl)CC1F.CC(C)C1(CC#N)CCN(Cc2cc(C(F)F)ccc2F)CC1F.CC(C)C1(CC#N)CCN(Cc2ccc(-n3nccn3)c(O)c2)CC1.CC(C)C1(CC#N)CCN(Cc2ccc(C3CC3)cc2)CC1F
InChIInChI=1S/C20H24ClFN2.C20H26F2N2O.C20H27FN2O.C20H27FN2.C19H25N5O.C18H24ClFN2O.C18H22F4N2/c1-5-15-6-7-16(17(21)12-15)13-24-11-9-20(8-10-23,18(22)14-24)19(2,3)4;1-13(2)16-10-17(21)15(9-18(16)25)11-24-8-6-20(5-7-23,14(3)4)19(22)12-24;1-5-16-7-6-15(12-17(16)24)13-23-11-9-20(8-10-22,18(21)14-23)19(2,3)4;1-15(2)20(9-11-22)10-12-23(14-19(20)21)13-16-3-5-17(6-4-16)18-7-8-18;1-15(2)19(5-8-20)6-11-23(12-7-19)14-16-3-4-17(18(25)13-16)24-21-9-10-22-24;1-17(2,3)18(6-8-21)7-9-22(12-16(18)20)11-13-10-14(23)4-5-15(13)19;1-12(2)18(5-7-23)6-8-24(11-16(18)20)10-14-9-13(17(21)22)3-4-15(14)19/h1,6-7,12,18H,8-9,11,13-14H2,2-4H3;9-10,14,19,25H,1,5-6,8,11-12H2,2-4H3;5-7,12,18,24H,1,8-9,11,13-14H2,2-4H3;3-6,15,18-19H,7-10,12-14H2,1-2H3;3-4,9-10,13,15,25H,5-7,11-12,14H2,1-2H3;4-5,10,16,23H,6-7,9,11-12H2,1-3H3;3-4,9,12,16-17H,5-6,8,10-11H2,1-2H3
InChIKeyRRYSGFOEPJRAGQ-UHFFFAOYSA-N
MW2360.89 g/mol
LogP31.19
Rot. Bonds30

About 2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile

2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile (PubChem CID 160711866) has the molecular formula C135H175Cl2F10N17O4 and a molecular weight of 2360.89 g/mol. Its IUPAC name is 2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile.

Molecular Properties

Compound Name2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile
PubChem CID160711866
Molecular FormulaC135H175Cl2F10N17O4
Molecular Weight2360.89 g/mol
Exact Mass2358.32
IUPAC Name2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile
SMILESC#Cc1ccc(CN2CCC(CC#N)(C(C)(C)C)C(F)C2)c(Cl)c1.C=C(C)c1cc(F)c(CN2CCC(CC#N)(C(C)C)C(F)C2)cc1O.C=Cc1ccc(CN2CCC(CC#N)(C(C)(C)C)C(F)C2)cc1O.CC(C)(C)C1(CC#N)CCN(Cc2cc(O)ccc2Cl)CC1F.CC(C)C1(CC#N)CCN(Cc2cc(C(F)F)ccc2F)CC1F.CC(C)C1(CC#N)CCN(Cc2ccc(-n3nccn3)c(O)c2)CC1.CC(C)C1(CC#N)CCN(Cc2ccc(C3CC3)cc2)CC1F
InChIInChI=1S/C20H24ClFN2.C20H26F2N2O.C20H27FN2O.C20H27FN2.C19H25N5O.C18H24ClFN2O.C18H22F4N2/c1-5-15-6-7-16(17(21)12-15)13-24-11-9-20(8-10-23,18(22)14-24)19(2,3)4;1-13(2)16-10-17(21)15(9-18(16)25)11-24-8-6-20(5-7-23,14(3)4)19(22)12-24;1-5-16-7-6-15(12-17(16)24)13-23-11-9-20(8-10-22,18(21)14-23)19(2,3)4;1-15(2)20(9-11-22)10-12-23(14-19(20)21)13-16-3-5-17(6-4-16)18-7-8-18;1-15(2)19(5-8-20)6-11-23(12-7-19)14-16-3-4-17(18(25)13-16)24-21-9-10-22-24;1-17(2,3)18(6-8-21)7-9-22(12-16(18)20)11-13-10-14(23)4-5-15(13)19;1-12(2)18(5-7-23)6-8-24(11-16(18)20)10-14-9-13(17(21)22)3-4-15(14)19/h1,6-7,12,18H,8-9,11,13-14H2,2-4H3;9-10,14,19,25H,1,5-6,8,11-12H2,2-4H3;5-7,12,18,24H,1,8-9,11,13-14H2,2-4H3;3-6,15,18-19H,7-10,12-14H2,1-2H3;3-4,9-10,13,15,25H,5-7,11-12,14H2,1-2H3;4-5,10,16,23H,6-7,9,11-12H2,1-3H3;3-4,9,12,16-17H,5-6,8,10-11H2,1-2H3
InChIKeyRRYSGFOEPJRAGQ-UHFFFAOYSA-N
XLogP31.19
TPSA300.84 Ų
H-Bond Donors4
H-Bond Acceptors21
Rotatable Bonds30
Heavy Atoms168
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002360.89
LogP ≤ 531.19
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

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

Analyze 2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile?
The IUPAC name of 2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile (CID 160711866) is 2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile.
What is the SMILES notation for 2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile?
The canonical SMILES for 2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile is C#Cc1ccc(CN2CCC(CC#N)(C(C)(C)C)C(F)C2)c(Cl)c1.C=C(C)c1cc(F)c(CN2CCC(CC#N)(C(C)C)C(F)C2)cc1O.C=Cc1ccc(CN2CCC(CC#N)(C(C)(C)C)C(F)C2)cc1O.CC(C)(C)C1(CC#N)CCN(Cc2cc(O)ccc2Cl)CC1F.CC(C)C1(CC#N)CCN(Cc2cc(C(F)F)ccc2F)CC1F.CC(C)C1(CC#N)CCN(Cc2ccc(-n3nccn3)c(O)c2)CC1.CC(C)C1(CC#N)CCN(Cc2ccc(C3CC3)cc2)CC1F.
What is the InChIKey of 2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile?
The InChIKey is RRYSGFOEPJRAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClFN2.C20H26F2N2O.C20H27FN2O.C20H27FN2.C19H25N5O.C18H24ClFN2O.C18H22F4N2/c1-5-15-6-7-16(17(21)12-15)13-24-11-9-20(8-10-23,18(22)14-24)19(2,3)4;1-13(2)16-10-17(21)15(9-18(16)25)11-24-8-6-20(5-7-23,14(3)4)19(22)12-24;1-5-16-7-6-15(12-17(16)24)13-23-11-9-20(8-10-22,18(21)14-23)19(2,3)4;1-15(2)20(9-11-22)10-12-23(14-19(20)21)13-16-3-5-17(6-4-16)18-7-8-18;1-15(2)19(5-8-20)6-11-23(12-7-19)14-16-3-4-17(18(25)13-16)24-21-9-10-22-24;1-17(2,3)18(6-8-21)7-9-22(12-16(18)20)11-13-10-14(23)4-5-15(13)19;1-12(2)18(5-7-23)6-8-24(11-16(18)20)10-14-9-13(17(21)22)3-4-15(14)19/h1,6-7,12,18H,8-9,11,13-14H2,2-4H3;9-10,14,19,25H,1,5-6,8,11-12H2,2-4H3;5-7,12,18,24H,1,8-9,11,13-14H2,2-4H3;3-6,15,18-19H,7-10,12-14H2,1-2H3;3-4,9-10,13,15,25H,5-7,11-12,14H2,1-2H3;4-5,10,16,23H,6-7,9,11-12H2,1-3H3;3-4,9,12,16-17H,5-6,8,10-11H2,1-2H3.
What are the key properties of 2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile?
2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile has a molecular weight of 2360.89 g/mol, XLogP of 31.19, 30 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-tert-butyl-1-[(2-chloro-4-ethynylphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(2-chloro-5-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[4-tert-butyl-1-[(4-ethenyl-3-hydroxyphenyl)methyl]-3-fluoropiperidin-4-yl]acetonitrile;2-[1-[(4-cyclopropylphenyl)methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[5-(difluoromethyl)-2-fluorophenyl]methyl]-3-fluoro-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[3-fluoro-1-[(2-fluoro-5-hydroxy-4-prop-1-en-2-ylphenyl)methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile;2-[1-[[3-hydroxy-4-(triazol-2-yl)phenyl]methyl]-4-propan-2-ylpiperidin-4-yl]acetonitrile is sourced from PubChem (CID 160711866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).