1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine

C145H199F4N15 — CID 158338039

IUPAC1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine
SMILESCC(C)(C)[C@]1(CC#N)CCN(Cc2ccc(-c3ccccc3)cc2)C[C@H]1F.[C-]#[N+]CC1(C(C)(C)C)CCN(C(C)c2ccccc2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(CC(F)(F)F)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(N3CCCCC3)cc2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2cccc(-c3ccccc3)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccccc2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccccc2-c2ccccc2)CC1
InChIInChI=1S/C24H29FN2.2C24H30N2.C23H35N3.C19H28N2.C18H26N2.C13H21F3N2/c1-23(2,3)24(13-15-26)14-16-27(18-22(24)25)17-19-9-11-21(12-10-19)20-7-5-4-6-8-20;1-23(2,3)24(19-25-4)13-15-26(16-14-24)18-20-9-8-12-22(17-20)21-10-6-5-7-11-21;1-23(2,3)24(19-25-4)14-16-26(17-15-24)18-21-12-8-9-13-22(21)20-10-6-5-7-11-20;1-22(2,3)23(19-24-4)12-16-25(17-13-23)18-20-8-10-21(11-9-20)26-14-6-5-7-15-26;1-16(17-9-7-6-8-10-17)21-13-11-19(12-14-21,15-20-5)18(2,3)4;1-17(2,3)18(15-19-4)10-12-20(13-11-18)14-16-8-6-5-7-9-16;1-11(2,3)12(9-17-4)5-7-18(8-6-12)10-13(14,15)16/h4-12,22H,13-14,16-18H2,1-3H3;5-12,17H,13-16,18-19H2,1-3H3;5-13H,14-19H2,1-3H3;8-11H,5-7,12-19H2,1-3H3;6-10,16H,11-15H2,1-4H3;5-9H,10-15H2,1-3H3;5-10H2,1-3H3/t22-,24-;;;;;;/m1....../s1
InChIKeyGQVAUGGMOZAQPH-GMDJNARCSA-N
MW2228.28 g/mol
LogP35.50
Rot. Bonds24

About 1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine

1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine (PubChem CID 158338039) has the molecular formula C145H199F4N15 and a molecular weight of 2228.28 g/mol. Its IUPAC name is 1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine.

Molecular Properties

Compound Name1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine
PubChem CID158338039
Molecular FormulaC145H199F4N15
Molecular Weight2228.28 g/mol
Exact Mass2226.60
IUPAC Name1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine
SMILESCC(C)(C)[C@]1(CC#N)CCN(Cc2ccc(-c3ccccc3)cc2)C[C@H]1F.[C-]#[N+]CC1(C(C)(C)C)CCN(C(C)c2ccccc2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(CC(F)(F)F)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(N3CCCCC3)cc2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2cccc(-c3ccccc3)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccccc2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccccc2-c2ccccc2)CC1
InChIInChI=1S/C24H29FN2.2C24H30N2.C23H35N3.C19H28N2.C18H26N2.C13H21F3N2/c1-23(2,3)24(13-15-26)14-16-27(18-22(24)25)17-19-9-11-21(12-10-19)20-7-5-4-6-8-20;1-23(2,3)24(19-25-4)13-15-26(16-14-24)18-20-9-8-12-22(17-20)21-10-6-5-7-11-21;1-23(2,3)24(19-25-4)14-16-26(17-15-24)18-21-12-8-9-13-22(21)20-10-6-5-7-11-20;1-22(2,3)23(19-24-4)12-16-25(17-13-23)18-20-8-10-21(11-9-20)26-14-6-5-7-15-26;1-16(17-9-7-6-8-10-17)21-13-11-19(12-14-21,15-20-5)18(2,3)4;1-17(2,3)18(15-19-4)10-12-20(13-11-18)14-16-8-6-5-7-9-16;1-11(2,3)12(9-17-4)5-7-18(8-6-12)10-13(14,15)16/h4-12,22H,13-14,16-18H2,1-3H3;5-12,17H,13-16,18-19H2,1-3H3;5-13H,14-19H2,1-3H3;8-11H,5-7,12-19H2,1-3H3;6-10,16H,11-15H2,1-4H3;5-9H,10-15H2,1-3H3;5-10H2,1-3H3/t22-,24-;;;;;;/m1....../s1
InChIKeyGQVAUGGMOZAQPH-GMDJNARCSA-N
XLogP35.50
TPSA75.87 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds24
Heavy Atoms164
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002228.28
LogP ≤ 535.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine with MolForge

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

Launch Full Analysis

Related Compounds

4-[11,17-Bis[4-cyano-2-(trifluoromethyl)phenyl]-8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl]-3-(trifluoromethyl)benzonitrile
CID 168327419
N-[4-(trifluoromethyl)phenyl]-N,1-bis[[3-(3,4,5-trimethylphenyl)phenyl]methyl]piperidin-4-amine
CID 21352475
1-[4-[4-[4-[4-(4-Piperidin-1-ylphenyl)buta-1,3-dienyl]-2-(trifluoromethyl)phenyl]buta-1,3-dienyl]phenyl]piperidine
CID 54308802
(Z)-3-[4-[(E)-2-cyano-2-(2,3,4,5,6-pentafluorophenyl)ethenyl]-2,5-bis[4-(dimethylamino)phenyl]phenyl]-2-(2,3,4,5,6-pentafluorophenyl)prop-2-enenitrile
CID 142658511
(Z)-3-[4-[(Z)-2-cyano-2-(2,3,4,5,6-pentafluorophenyl)ethenyl]-2,5-bis[4-(dimethylamino)phenyl]phenyl]-2-(2,3,4,5,6-pentafluorophenyl)prop-2-enenitrile
CID 142903708
4-[[4-[3-[4-(1-Aminoethenyl)phenyl]phenyl]-3-methyl-3-(1-methylpiperidin-4-yl)but-1-en-2-yl]amino]-2-(trifluoromethyl)benzonitrile;ethane;1,4-xylene
CID 143819566
4-[1-[3-(3-Cyclopropylphenyl)phenyl]-2-[1-(4-methylphenyl)piperidin-4-yl]propan-2-yl]-2-(trifluoromethyl)benzonitrile;ethane;ethenamine;prop-1-ene
CID 143819651
1-N,6-N-bis[2,4-bis(3,5-dimethylphenyl)phenyl]-1-N,6-N-bis(4-fluorophenyl)-1,10c-dihydropyrene-1,6-diamine;6-N-[2,4-bis(2,4-dimethylphenyl)phenyl]-1-N-[4-(2,4-dimethylphenyl)-2-(2-methylphenyl)phenyl]-1-N,6-N-bis[4-(trifluoromethyl)phenyl]-1,10c-dihydropyrene-1,6-diamine;4-[N-[6-(N-[2,4-bis(3,5-dimethylphenyl)phenyl]-4-isocyanoanilino)-1,10c-dihydropyren-1-yl]-2,4-bis(3,5-dimethylphenyl)anilino]benzonitrile
CID 157077385
4-Tert-butyl-4-(isocyanomethyl)-1-[(2-isocyanophenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-methylphenyl)methyl]piperidine;3-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]benzonitrile;4-[[4-tert-butyl-4-(isocyanomethyl)piperidin-1-yl]methyl]benzonitrile;4-tert-butyl-4-(isocyanomethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[[3-(trifluoromethylsulfanyl)phenyl]methyl]piperidine
CID 157110159
1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine;ethane;2-[(3S,4R)-3-fluoro-4-methyl-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile
CID 157579409
1-N,6-N-bis[2,4-bis(3,4-dimethylphenyl)phenyl]-1-N,6-N-bis(4-fluorophenyl)-1,10c-dihydropyrene-1,6-diamine;1-N,6-N-bis[2,4-bis(3-methylphenyl)phenyl]-1-N,6-N-bis[4-(trifluoromethyl)phenyl]-1,10c-dihydropyrene-1,6-diamine;4-[N-[6-(N-[2,4-bis(3-methylphenyl)phenyl]-4-isocyanoanilino)-1,10c-dihydropyren-1-yl]-2,4-bis(3-methylphenyl)anilino]benzonitrile
CID 157803087
4-Tert-butyl-1-[(4-chlorophenyl)methyl]-4-(isocyanomethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-isocyanophenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-methylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]piperidine;3-[[4-(isocyanomethyl)-4-propan-2-ylpiperidin-1-yl]methyl]benzonitrile
CID 157840902

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine?
The IUPAC name of 1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine (CID 158338039) is 1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine.
What is the SMILES notation for 1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine?
The canonical SMILES for 1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine is CC(C)(C)[C@]1(CC#N)CCN(Cc2ccc(-c3ccccc3)cc2)C[C@H]1F.[C-]#[N+]CC1(C(C)(C)C)CCN(C(C)c2ccccc2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(CC(F)(F)F)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccc(N3CCCCC3)cc2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2cccc(-c3ccccc3)c2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccccc2)CC1.[C-]#[N+]CC1(C(C)(C)C)CCN(Cc2ccccc2-c2ccccc2)CC1.
What is the InChIKey of 1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine?
The InChIKey is GQVAUGGMOZAQPH-GMDJNARCSA-N. The full InChI is InChI=1S/C24H29FN2.2C24H30N2.C23H35N3.C19H28N2.C18H26N2.C13H21F3N2/c1-23(2,3)24(13-15-26)14-16-27(18-22(24)25)17-19-9-11-21(12-10-19)20-7-5-4-6-8-20;1-23(2,3)24(19-25-4)13-15-26(16-14-24)18-20-9-8-12-22(17-20)21-10-6-5-7-11-21;1-23(2,3)24(19-25-4)14-16-26(17-15-24)18-21-12-8-9-13-22(21)20-10-6-5-7-11-20;1-22(2,3)23(19-24-4)12-16-25(17-13-23)18-20-8-10-21(11-9-20)26-14-6-5-7-15-26;1-16(17-9-7-6-8-10-17)21-13-11-19(12-14-21,15-20-5)18(2,3)4;1-17(2,3)18(15-19-4)10-12-20(13-11-18)14-16-8-6-5-7-9-16;1-11(2,3)12(9-17-4)5-7-18(8-6-12)10-13(14,15)16/h4-12,22H,13-14,16-18H2,1-3H3;5-12,17H,13-16,18-19H2,1-3H3;5-13H,14-19H2,1-3H3;8-11H,5-7,12-19H2,1-3H3;6-10,16H,11-15H2,1-4H3;5-9H,10-15H2,1-3H3;5-10H2,1-3H3/t22-,24-;;;;;;/m1....../s1.
What are the key properties of 1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine?
1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine has a molecular weight of 2228.28 g/mol, XLogP of 35.50, 24 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-tert-butyl-4-(isocyanomethyl)piperidine;2-[(3S,4R)-4-tert-butyl-3-fluoro-1-[(4-phenylphenyl)methyl]piperidin-4-yl]acetonitrile;4-tert-butyl-4-(isocyanomethyl)-1-(1-phenylethyl)piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(2-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(3-phenylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-[(4-piperidin-1-ylphenyl)methyl]piperidine;4-tert-butyl-4-(isocyanomethyl)-1-(2,2,2-trifluoroethyl)piperidine is sourced from PubChem (CID 158338039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).