2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane

C132H202F8N2O21 — CID 159557280

IUPAC2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane
SMILESC=CCO[C@@H](CC(C)C)c1cc(F)ccc1OC.CC(C)C[C@H](OC(C)C)c1cc(F)ccc1OCC1COC1.COCCCO[C@@H](CC(C)C)c1cc(F)ccc1OC.COCCO[C@@H](CC(C)C)c1cc(F)ccc1OC.COCCOc1ccc(F)cc1[C@H](CC(C)C)OC1CCCCC1.COc1ccc(F)cc1[C@H](CC(C)C)OCC(C)(C)C.COc1ccc(F)cc1[C@H](CC(C)C)OCCC(N)=O.COc1ccc(F)cc1[C@H](CC(C)C)OCCN(C)C
InChIInChI=1S/C20H31FO3.C18H27FO3.C17H27FO2.C16H26FNO2.C16H25FO3.C15H22FNO3.C15H23FO3.C15H21FO2/c1-15(2)13-20(24-17-7-5-4-6-8-17)18-14-16(21)9-10-19(18)23-12-11-22-3;1-12(2)7-18(22-13(3)4)16-8-15(19)5-6-17(16)21-11-14-9-20-10-14;1-12(2)9-16(20-11-17(3,4)5)14-10-13(18)7-8-15(14)19-6;1-12(2)10-16(20-9-8-18(3)4)14-11-13(17)6-7-15(14)19-5;1-12(2)10-16(20-9-5-8-18-3)14-11-13(17)6-7-15(14)19-4;1-10(2)8-14(20-7-6-15(17)18)12-9-11(16)4-5-13(12)19-3;1-11(2)9-15(19-8-7-17-3)13-10-12(16)5-6-14(13)18-4;1-5-8-18-15(9-11(2)3)13-10-12(16)6-7-14(13)17-4/h9-10,14-15,17,20H,4-8,11-13H2,1-3H3;5-6,8,12-14,18H,7,9-11H2,1-4H3;7-8,10,12,16H,9,11H2,1-6H3;6-7,11-12,16H,8-10H2,1-5H3;6-7,11-12,16H,5,8-10H2,1-4H3;4-5,9-10,14H,6-8H2,1-3H3,(H2,17,18);5-6,10-11,15H,7-9H2,1-4H3;5-7,10-11,15H,1,8-9H2,2-4H3/t20-;18-;3*16-;14-;2*15-/m00000000/s1
InChIKeyMGDQNOQNRMDLSD-IVDMBAPASA-N
MW2305.04 g/mol
LogP32.63
Rot. Bonds63

About 2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane

2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane (PubChem CID 159557280) has the molecular formula C132H202F8N2O21 and a molecular weight of 2305.04 g/mol. Its IUPAC name is 2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane.

Molecular Properties

Compound Name2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane
PubChem CID159557280
Molecular FormulaC132H202F8N2O21
Molecular Weight2305.04 g/mol
Exact Mass2303.47
IUPAC Name2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane
SMILESC=CCO[C@@H](CC(C)C)c1cc(F)ccc1OC.CC(C)C[C@H](OC(C)C)c1cc(F)ccc1OCC1COC1.COCCCO[C@@H](CC(C)C)c1cc(F)ccc1OC.COCCO[C@@H](CC(C)C)c1cc(F)ccc1OC.COCCOc1ccc(F)cc1[C@H](CC(C)C)OC1CCCCC1.COc1ccc(F)cc1[C@H](CC(C)C)OCC(C)(C)C.COc1ccc(F)cc1[C@H](CC(C)C)OCCC(N)=O.COc1ccc(F)cc1[C@H](CC(C)C)OCCN(C)C
InChIInChI=1S/C20H31FO3.C18H27FO3.C17H27FO2.C16H26FNO2.C16H25FO3.C15H22FNO3.C15H23FO3.C15H21FO2/c1-15(2)13-20(24-17-7-5-4-6-8-17)18-14-16(21)9-10-19(18)23-12-11-22-3;1-12(2)7-18(22-13(3)4)16-8-15(19)5-6-17(16)21-11-14-9-20-10-14;1-12(2)9-16(20-11-17(3,4)5)14-10-13(18)7-8-15(14)19-6;1-12(2)10-16(20-9-8-18(3)4)14-11-13(17)6-7-15(14)19-5;1-12(2)10-16(20-9-5-8-18-3)14-11-13(17)6-7-15(14)19-4;1-10(2)8-14(20-7-6-15(17)18)12-9-11(16)4-5-13(12)19-3;1-11(2)9-15(19-8-7-17-3)13-10-12(16)5-6-14(13)18-4;1-5-8-18-15(9-11(2)3)13-10-12(16)6-7-14(13)17-4/h9-10,14-15,17,20H,4-8,11-13H2,1-3H3;5-6,8,12-14,18H,7,9-11H2,1-4H3;7-8,10,12,16H,9,11H2,1-6H3;6-7,11-12,16H,8-10H2,1-5H3;6-7,11-12,16H,5,8-10H2,1-4H3;4-5,9-10,14H,6-8H2,1-3H3,(H2,17,18);5-6,10-11,15H,7-9H2,1-4H3;5-7,10-11,15H,1,8-9H2,2-4H3/t20-;18-;3*16-;14-;2*15-/m00000000/s1
InChIKeyMGDQNOQNRMDLSD-IVDMBAPASA-N
XLogP32.63
TPSA230.93 Ų
H-Bond Donors1
H-Bond Acceptors22
Rotatable Bonds63
Heavy Atoms163
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002305.04
LogP ≤ 532.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane 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

1-[(1S)-1-cyclohexyloxy-3-methylbutyl]-2-methoxybenzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;bis(4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-(2-methylpropoxy)butyl]benzene);methane;1-methoxy-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]benzene
CID 160661727
2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-methoxybenzene;1-[(1S)-1-cyclohexyloxy-3-methylbutyl]-2-methoxybenzene;2-[(1S)-1-ethoxy-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-(4-methylidenecyclohexyl)oxybutyl]benzene;tris(4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-(2-methylpropoxy)butyl]benzene);4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]ethanol;2-[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]ethanol;methane
CID 159606490
2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]ethanol
CID 129227461
[2-cyclohexyl-1-(5-fluoro-2-methoxyphenyl)ethyl]hydrazine
CID 105330836
tert-butyl-[1-[3-(5-fluoro-2-methoxyphenoxy)propyl]piperidin-4-yl]carbamic acid
CID 67854468
1-[2-[3-(dimethylamino)propoxy]-5-fluorophenyl]ethanol
CID 114525691
2-[1-[(2R)-2-[5-fluoro-2-(oxetan-3-ylmethoxy)phenyl]-2-propan-2-yloxyethyl]-5-methyl-2,4-dioxo-6-(triazol-2-yl)thieno[2,3-d]pyrimidin-3-yl]-2-methyl-N-propan-2-ylpropanamide
CID 129165620
3-[2-[(cyclopropylamino)methyl]-4-fluorophenoxy]propanamide
CID 107696299
2,2-dimethylpropyl (3S,4R)-3-formyl-4-[[[4-methoxy-3-(3-methoxypropoxy)benzoyl]-propan-2-ylamino]methyl]pyrrolidine-1-carboxylate
CID 143248742
ethyl 4-[(1R)-1-(5-fluoro-2-methoxyphenyl)-2-hydroxyethoxy]cyclohexane-1-carboxylate
CID 129176513
4-methoxy-3-(3-methoxypropoxy)-N-methyl-N-propan-2-ylbenzamide
CID 59224071
1-[(2R)-2-[5-fluoro-2-(oxetan-3-ylmethoxy)phenyl]-2-(oxan-4-yloxy)ethyl]-5-methyl-3-(2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-6-pyrazol-1-ylthieno[2,3-d]pyrimidine-2,4-dione
CID 129182555

Frequently Asked Questions

What is the IUPAC name of 2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane?
The IUPAC name of 2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane (CID 159557280) is 2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane.
What is the SMILES notation for 2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane?
The canonical SMILES for 2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane is C=CCO[C@@H](CC(C)C)c1cc(F)ccc1OC.CC(C)C[C@H](OC(C)C)c1cc(F)ccc1OCC1COC1.COCCCO[C@@H](CC(C)C)c1cc(F)ccc1OC.COCCO[C@@H](CC(C)C)c1cc(F)ccc1OC.COCCOc1ccc(F)cc1[C@H](CC(C)C)OC1CCCCC1.COc1ccc(F)cc1[C@H](CC(C)C)OCC(C)(C)C.COc1ccc(F)cc1[C@H](CC(C)C)OCCC(N)=O.COc1ccc(F)cc1[C@H](CC(C)C)OCCN(C)C.
What is the InChIKey of 2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane?
The InChIKey is MGDQNOQNRMDLSD-IVDMBAPASA-N. The full InChI is InChI=1S/C20H31FO3.C18H27FO3.C17H27FO2.C16H26FNO2.C16H25FO3.C15H22FNO3.C15H23FO3.C15H21FO2/c1-15(2)13-20(24-17-7-5-4-6-8-17)18-14-16(21)9-10-19(18)23-12-11-22-3;1-12(2)7-18(22-13(3)4)16-8-15(19)5-6-17(16)21-11-14-9-20-10-14;1-12(2)9-16(20-11-17(3,4)5)14-10-13(18)7-8-15(14)19-6;1-12(2)10-16(20-9-8-18(3)4)14-11-13(17)6-7-15(14)19-5;1-12(2)10-16(20-9-5-8-18-3)14-11-13(17)6-7-15(14)19-4;1-10(2)8-14(20-7-6-15(17)18)12-9-11(16)4-5-13(12)19-3;1-11(2)9-15(19-8-7-17-3)13-10-12(16)5-6-14(13)18-4;1-5-8-18-15(9-11(2)3)13-10-12(16)6-7-14(13)17-4/h9-10,14-15,17,20H,4-8,11-13H2,1-3H3;5-6,8,12-14,18H,7,9-11H2,1-4H3;7-8,10,12,16H,9,11H2,1-6H3;6-7,11-12,16H,8-10H2,1-5H3;6-7,11-12,16H,5,8-10H2,1-4H3;4-5,9-10,14H,6-8H2,1-3H3,(H2,17,18);5-6,10-11,15H,7-9H2,1-4H3;5-7,10-11,15H,1,8-9H2,2-4H3/t20-;18-;3*16-;14-;2*15-/m00000000/s1.
What are the key properties of 2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane?
2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane has a molecular weight of 2305.04 g/mol, XLogP of 32.63, 63 rotatable bonds, 1 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1S)-1-cyclohexyloxy-3-methylbutyl]-4-fluoro-1-(2-methoxyethoxy)benzene;2-[(1S)-1-(2,2-dimethylpropoxy)-3-methylbutyl]-4-fluoro-1-methoxybenzene;4-fluoro-1-methoxy-2-[(1S)-1-(2-methoxyethoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-1-(3-methoxypropoxy)-3-methylbutyl]benzene;4-fluoro-1-methoxy-2-[(1S)-3-methyl-1-prop-2-enoxybutyl]benzene;2-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]-N,N-dimethylethanamine;3-[(1S)-1-(5-fluoro-2-methoxyphenyl)-3-methylbutoxy]propanamide;3-[[4-fluoro-2-[(1S)-3-methyl-1-propan-2-yloxybutyl]phenoxy]methyl]oxetane is sourced from PubChem (CID 159557280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).