(3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine

C179H223ClF5N19O — CID 159531149

IUPAC(3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine
SMILES[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(C#N)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(C)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(Cl)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(OC)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccncc3)cc2)CC1.[C-]#[N+]CC1(C(C)C)CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)nc2)CC1.[C-]#[N+]C[C@]1(C(C)C)CCN(Cc2ccccc2)C[C@@H]1F.[C-]#[N+]C[C@]1(C(C)C)CCN(Cc2ccccc2)C[C@H]1F
InChIInChI=1S/C25H29N3.C25H32N2O.C25H32N2.C24H29ClN2.C23H26F3N3.C23H29N3.2C17H23FN2/c1-24(2,3)25(19-27-4)12-14-28(15-13-25)18-20-10-11-23(22(16-20)17-26)21-8-6-5-7-9-21;1-24(2,3)25(19-26-4)13-15-27(16-14-25)18-20-11-12-22(23(17-20)28-5)21-9-7-6-8-10-21;1-20-17-21(11-12-23(20)22-9-7-6-8-10-22)18-27-15-13-25(14-16-27,19-26-5)24(2,3)4;1-23(2,3)24(18-26-4)12-14-27(15-13-24)17-19-10-11-21(22(25)16-19)20-8-6-5-7-9-20;1-17(2)22(16-27-3)10-12-29(13-11-22)15-18-4-9-21(28-14-18)19-5-7-20(8-6-19)23(24,25)26;1-22(2,3)23(18-24-4)11-15-26(16-12-23)17-19-5-7-20(8-6-19)21-9-13-25-14-10-21;2*1-14(2)17(13-19-3)9-10-20(12-16(17)18)11-15-7-5-4-6-8-15/h5-11,16H,12-15,18-19H2,1-3H3;6-12,17H,13-16,18-19H2,1-3,5H3;6-12,17H,13-16,18-19H2,1-4H3;5-11,16H,12-15,17-18H2,1-3H3;4-9,14,17H,10-13,15-16H2,1-2H3;5-10,13-14H,11-12,15-18H2,1-3H3;2*4-8,14,16H,9-13H2,1-2H3/t;;;;;;16-,17+;16-,17-/m......10/s1
InChIKeyMCZYFUQGDUZZDR-FVJHIYFTSA-N
MW2787.33 g/mol
LogP43.25
Rot. Bonds34

About (3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine

(3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine (PubChem CID 159531149) has the molecular formula C179H223ClF5N19O and a molecular weight of 2787.33 g/mol. Its IUPAC name is (3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name(3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine
PubChem CID159531149
Molecular FormulaC179H223ClF5N19O
Molecular Weight2787.33 g/mol
Exact Mass2784.76
IUPAC Name(3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine
SMILES[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(C#N)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(C)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(Cl)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(OC)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccncc3)cc2)CC1.[C-]#[N+]CC1(C(C)C)CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)nc2)CC1.[C-]#[N+]C[C@]1(C(C)C)CCN(Cc2ccccc2)C[C@@H]1F.[C-]#[N+]C[C@]1(C(C)C)CCN(Cc2ccccc2)C[C@H]1F
InChIInChI=1S/C25H29N3.C25H32N2O.C25H32N2.C24H29ClN2.C23H26F3N3.C23H29N3.2C17H23FN2/c1-24(2,3)25(19-27-4)12-14-28(15-13-25)18-20-10-11-23(22(16-20)17-26)21-8-6-5-7-9-21;1-24(2,3)25(19-26-4)13-15-27(16-14-25)18-20-11-12-22(23(17-20)28-5)21-9-7-6-8-10-21;1-20-17-21(11-12-23(20)22-9-7-6-8-10-22)18-27-15-13-25(14-16-27,19-26-5)24(2,3)4;1-23(2,3)24(18-26-4)12-14-27(15-13-24)17-19-10-11-21(22(25)16-19)20-8-6-5-7-9-20;1-17(2)22(16-27-3)10-12-29(13-11-22)15-18-4-9-21(28-14-18)19-5-7-20(8-6-19)23(24,25)26;1-22(2,3)23(18-24-4)11-15-26(16-12-23)17-19-5-7-20(8-6-19)21-9-13-25-14-10-21;2*1-14(2)17(13-19-3)9-10-20(12-16(17)18)11-15-7-5-4-6-8-15/h5-11,16H,12-15,18-19H2,1-3H3;6-12,17H,13-16,18-19H2,1-3,5H3;6-12,17H,13-16,18-19H2,1-4H3;5-11,16H,12-15,17-18H2,1-3H3;4-9,14,17H,10-13,15-16H2,1-2H3;5-10,13-14H,11-12,15-18H2,1-3H3;2*4-8,14,16H,9-13H2,1-2H3/t;;;;;;16-,17+;16-,17-/m......10/s1
InChIKeyMCZYFUQGDUZZDR-FVJHIYFTSA-N
XLogP43.25
TPSA119.60 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds34
Heavy Atoms205
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002787.33
LogP ≤ 543.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze (3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of (3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of (3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine (CID 159531149) is (3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for (3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for (3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine is [C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(C#N)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(C)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(Cl)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccccc3)c(OC)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(-c3ccncc3)cc2)CC1.[C-]#[N+]CC1(C(C)C)CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)nc2)CC1.[C-]#[N+]C[C@]1(C(C)C)CCN(Cc2ccccc2)C[C@@H]1F.[C-]#[N+]C[C@]1(C(C)C)CCN(Cc2ccccc2)C[C@H]1F.
What is the InChIKey of (3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine?
The InChIKey is MCZYFUQGDUZZDR-FVJHIYFTSA-N. The full InChI is InChI=1S/C25H29N3.C25H32N2O.C25H32N2.C24H29ClN2.C23H26F3N3.C23H29N3.2C17H23FN2/c1-24(2,3)25(19-27-4)12-14-28(15-13-25)18-20-10-11-23(22(16-20)17-26)21-8-6-5-7-9-21;1-24(2,3)25(19-26-4)13-15-27(16-14-25)18-20-11-12-22(23(17-20)28-5)21-9-7-6-8-10-21;1-20-17-21(11-12-23(20)22-9-7-6-8-10-22)18-27-15-13-25(14-16-27,19-26-5)24(2,3)4;1-23(2,3)24(18-26-4)12-14-27(15-13-24)17-19-10-11-21(22(25)16-19)20-8-6-5-7-9-20;1-17(2)22(16-27-3)10-12-29(13-11-22)15-18-4-9-21(28-14-18)19-5-7-20(8-6-19)23(24,25)26;1-22(2,3)23(18-24-4)11-15-26(16-12-23)17-19-5-7-20(8-6-19)21-9-13-25-14-10-21;2*1-14(2)17(13-19-3)9-10-20(12-16(17)18)11-15-7-5-4-6-8-15/h5-11,16H,12-15,18-19H2,1-3H3;6-12,17H,13-16,18-19H2,1-3,5H3;6-12,17H,13-16,18-19H2,1-4H3;5-11,16H,12-15,17-18H2,1-3H3;4-9,14,17H,10-13,15-16H2,1-2H3;5-10,13-14H,11-12,15-18H2,1-3H3;2*4-8,14,16H,9-13H2,1-2H3/t;;;;;;16-,17+;16-,17-/m......10/s1.
What are the key properties of (3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine?
(3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine has a molecular weight of 2787.33 g/mol, XLogP of 43.25, 34 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;(3R,4R)-1-benzyl-3-fluoro-4-(isocyanomethyl)-4-propan-2-ylpiperidine;4-tert-butyl-1-[(3-chloro-4-phenylphenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methoxy-4-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-methyl-4-phenylphenyl)methyl]piperidine;5-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]-2-phenylbenzonitrile;4-[4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]phenyl]pyridine;5-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]-2-[4-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 159531149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).