tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine

C156H229N11O13 — CID 158646231

IUPACtert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine
SMILESCC(C)c1ccc(Cn2ccnc2)cc1.CC(C)c1ccc(N2CCOCC2)cc1.CC(C)c1ccc(OCC2CCCN2)cc1.CC(C)c1ccc(OCC2CCCN2C(=O)OC(C)(C)C)cc1.CC(C)c1ccc(OCC2CCNCC2)cc1.CC(C)c1ccc(OCCCCN)cc1.CC(C)c1ccc(OCCN2CCCCC2)cc1.CC(C)c1ccc(OCCc2ccccn2)cc1.CC(C)c1cccc(OCCN2CCOCC2)c1.CC(C)c1ccccc1O.COCCNCc1ccc(C(C)C)cc1
InChIInChI=1S/C19H29NO3.C16H19NO.C16H25NO.C15H23NO2.C15H23NO.C14H21NO.C13H16N2.C13H19NO.2C13H21NO.C9H12O/c1-14(2)15-8-10-17(11-9-15)22-13-16-7-6-12-20(16)18(21)23-19(3,4)5;1-13(2)14-6-8-16(9-7-14)18-12-10-15-5-3-4-11-17-15;1-14(2)15-6-8-16(9-7-15)18-13-12-17-10-4-3-5-11-17;1-13(2)14-4-3-5-15(12-14)18-11-8-16-6-9-17-10-7-16;1-12(2)14-3-5-15(6-4-14)17-11-13-7-9-16-10-8-13;1-11(2)12-5-7-14(8-6-12)16-10-13-4-3-9-15-13;1-11(2)13-5-3-12(4-6-13)9-15-8-7-14-10-15;1-11(2)12-3-5-13(6-4-12)14-7-9-15-10-8-14;1-11(2)13-6-4-12(5-7-13)10-14-8-9-15-3;1-11(2)12-5-7-13(8-6-12)15-10-4-3-9-14;1-7(2)8-5-3-4-6-9(8)10/h8-11,14,16H,6-7,12-13H2,1-5H3;3-9,11,13H,10,12H2,1-2H3;6-9,14H,3-5,10-13H2,1-2H3;3-5,12-13H,6-11H2,1-2H3;3-6,12-13,16H,7-11H2,1-2H3;5-8,11,13,15H,3-4,9-10H2,1-2H3;3-8,10-11H,9H2,1-2H3;3-6,11H,7-10H2,1-2H3;4-7,11,14H,8-10H2,1-3H3;5-8,11H,3-4,9-10,14H2,1-2H3;3-7,10H,1-2H3
InChIKeyIAZRVRWVIJIKEN-UHFFFAOYSA-N
MW2466.61 g/mol
LogP34.43
Rot. Bonds45

About tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine

tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine (PubChem CID 158646231) has the molecular formula C156H229N11O13 and a molecular weight of 2466.61 g/mol. Its IUPAC name is tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine.

Molecular Properties

Compound Nametert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine
PubChem CID158646231
Molecular FormulaC156H229N11O13
Molecular Weight2466.61 g/mol
Exact Mass2464.76
IUPAC Nametert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine
SMILESCC(C)c1ccc(Cn2ccnc2)cc1.CC(C)c1ccc(N2CCOCC2)cc1.CC(C)c1ccc(OCC2CCCN2)cc1.CC(C)c1ccc(OCC2CCCN2C(=O)OC(C)(C)C)cc1.CC(C)c1ccc(OCC2CCNCC2)cc1.CC(C)c1ccc(OCCCCN)cc1.CC(C)c1ccc(OCCN2CCCCC2)cc1.CC(C)c1ccc(OCCc2ccccn2)cc1.CC(C)c1cccc(OCCN2CCOCC2)c1.CC(C)c1ccccc1O.COCCNCc1ccc(C(C)C)cc1
InChIInChI=1S/C19H29NO3.C16H19NO.C16H25NO.C15H23NO2.C15H23NO.C14H21NO.C13H16N2.C13H19NO.2C13H21NO.C9H12O/c1-14(2)15-8-10-17(11-9-15)22-13-16-7-6-12-20(16)18(21)23-19(3,4)5;1-13(2)14-6-8-16(9-7-14)18-12-10-15-5-3-4-11-17-15;1-14(2)15-6-8-16(9-7-15)18-13-12-17-10-4-3-5-11-17;1-13(2)14-4-3-5-15(12-14)18-11-8-16-6-9-17-10-7-16;1-12(2)14-3-5-15(6-4-14)17-11-13-7-9-16-10-8-13;1-11(2)12-5-7-14(8-6-12)16-10-13-4-3-9-15-13;1-11(2)13-5-3-12(4-6-13)9-15-8-7-14-10-15;1-11(2)12-3-5-13(6-4-12)14-7-9-15-10-8-14;1-11(2)13-6-4-12(5-7-13)10-14-8-9-15-3;1-11(2)12-5-7-13(8-6-12)15-10-4-3-9-14;1-7(2)8-5-3-4-6-9(8)10/h8-11,14,16H,6-7,12-13H2,1-5H3;3-9,11,13H,10,12H2,1-2H3;6-9,14H,3-5,10-13H2,1-2H3;3-5,12-13H,6-11H2,1-2H3;3-6,12-13,16H,7-11H2,1-2H3;5-8,11,13,15H,3-4,9-10H2,1-2H3;3-8,10-11H,9H2,1-2H3;3-6,11H,7-10H2,1-2H3;4-7,11,14H,8-10H2,1-3H3;5-8,11H,3-4,9-10,14H2,1-2H3;3-7,10H,1-2H3
InChIKeyIAZRVRWVIJIKEN-UHFFFAOYSA-N
XLogP34.43
TPSA244.61 Ų
H-Bond Donors5
H-Bond Acceptors23
Rotatable Bonds45
Heavy Atoms180
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002466.61
LogP ≤ 534.43
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine with MolForge

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Related Compounds

Tert-butyl 3,3-difluoro-4-[6-(4-hydroxyphenyl)imidazo[1,5-a]pyridin-8-yl]oxypiperidine-1-carboxylate;4-[8-(3,3-difluoropiperidin-4-yl)oxyimidazo[1,5-a]pyridin-6-yl]phenol
CID 160452032
tert-butyl (3S)-3-[5-[6-methyl-10-[2-[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]-4,5-dihydro-1H-imidazol-5-yl]-6H-indolo[1,2-c][1,3]benzoxazin-3-yl]-1H-imidazol-2-yl]-2-azabicyclo[2.2.2]octane-2-carboxylate
CID 66837269
[4-(2-pyridin-4-yloxyethyl)phenyl] 4-[2-(1H-imidazol-5-yl)ethyl]piperazine-1-carboxylate;[4-(2-pyridin-4-yloxyethyl)phenyl] 4-[2-(1-methylimidazol-4-yl)ethyl]piperazine-1-carboxylate;[4-(2-pyridin-4-yloxyethyl)phenyl] 4-[2-(1H-pyrrol-2-yl)ethyl]piperazine-1-carboxylate
CID 87883004
tert-butyl (3S)-3-[[4-[2-[5-[[(1S,2R)-2-hydroxycyclohexyl]methyl]-2-methylnaphthalen-1-yl]oxy-3-pyridinyl]pyrimidin-2-yl]amino]piperidine-1-carboxylate;tert-butyl (3S)-3-[[4-[2-[5-[[(1R,2S)-2-hydroxycyclohexyl]methyl]-2-methylnaphthalen-1-yl]oxy-3-pyridinyl]pyrimidin-2-yl]amino]piperidine-1-carboxylate
CID 157268707
N,N-dimethyl-4-propan-2-ylaniline;N,N-dimethyl-3-(4-propan-2-ylphenoxy)propan-1-amine;methane;1-methyl-4-(4-propan-2-ylphenyl)piperazine;1-methyl-4-propan-2-ylpiperazine;2-propan-2-ylbenzene-1,3,5-triol;4-propan-2-ylbenzene-1,2,3-triol;2-propan-2-yl-1H-imidazole;4-propan-2-ylmorpholine;1-[2-(4-propan-2-ylphenyl)ethyl]pyrrolidine;1-(4-propan-2-ylphenyl)pyrrolidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine
CID 157425464
tert-butyl (3S)-3-[6-(4-hydroxyphenyl)imidazo[1,5-a]pyridin-8-yl]oxypyrrolidine-1-carboxylate;4-[8-[(3S)-pyrrolidin-3-yl]oxyimidazo[1,5-a]pyridin-6-yl]phenol
CID 157488820
1-(1,3-benzodioxol-5-ylmethyl)-4-tert-butylpiperazine;4-benzyl-1-tert-butylpiperidine;5-[2-(tert-butylamino)ethyl]-2-methylphenol;tert-butyl 4-tert-butylpiperazine-1-carboxylate;1-tert-butyl-4-phenylpiperazine;1-tert-butylpiperazine;1-tert-butylpiperidine;N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methylpropan-2-amine;N-ethyl-N-methylethanamine;N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropan-2-amine;methanamine;methane;N-methylhydroxylamine;N-methyl-1-phenylmethanamine
CID 157911527
Tert-butyl 4-[[6-(4-hydroxyphenyl)imidazo[1,5-a]pyridin-8-yl]oxymethyl]piperidine-1-carboxylate;4-[8-(piperidin-4-ylmethoxy)imidazo[1,5-a]pyridin-6-yl]phenol
CID 158264495
6-[4-[4-(diethylamino)butoxy]-3-methoxyphenyl]-N-(1-phenylbutyl)pyrazin-2-amine;6-[4-(3-imidazol-1-ylpropoxy)-3-methoxyphenyl]-N-(1-phenylbutyl)pyrazin-2-amine;6-[3-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-N-(1-phenylbutyl)pyrazin-2-amine;6-[3-methoxy-4-(4-morpholin-4-ylbutoxy)phenyl]-N-(1-phenylbutyl)pyrazin-2-amine;6-[3-methoxy-4-(4-piperidin-1-ylbutoxy)phenyl]-N-(1-phenylbutyl)pyrazin-2-amine;6-[3-methoxy-4-(4-pyrrolidin-1-ylbutoxy)phenyl]-N-(1-phenylbutyl)pyrazin-2-amine;5-oxo-N-[[4-[6-(1-phenylbutylamino)pyrazin-2-yl]phenyl]methyl]pyrrolidine-2-carboxamide;N-[[4-[6-(1-phenylbutylamino)pyrazin-2-yl]phenyl]methyl]piperidine-3-carboxamide
CID 158966480
tert-butyl (3R)-3-[2-cyano-4-[6-(4-morpholin-4-ylphenyl)-7H-pyrrolo[3,2-d]pyrimidin-4-yl]phenoxy]pyrrolidine-1-carboxylate;2-[1-(2-hydroxyacetyl)piperidin-4-yl]oxy-5-[6-(4-morpholin-4-ylphenyl)-7H-pyrrolo[3,2-d]pyrimidin-4-yl]benzonitrile;2-[(3R)-1-(2-hydroxyacetyl)pyrrolidin-3-yl]oxy-5-[6-(4-morpholin-4-ylphenyl)-7H-pyrrolo[3,2-d]pyrimidin-4-yl]benzonitrile;5-[6-(4-morpholin-4-ylphenyl)-7H-pyrrolo[3,2-d]pyrimidin-4-yl]-2-[(3R)-pyrrolidin-3-yl]oxybenzonitrile
CID 158993911
tert-butyl (2R,4R)-4-[6-(4-hydroxyphenyl)imidazo[1,5-a]pyridin-8-yl]oxy-2-methylpiperidine-1-carboxylate;4-[8-[(2R,4R)-2-methylpiperidin-4-yl]oxyimidazo[1,5-a]pyridin-6-yl]phenol
CID 158996051
tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine
CID 159149987

Frequently Asked Questions

What is the IUPAC name of tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine?
The IUPAC name of tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine (CID 158646231) is tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine.
What is the SMILES notation for tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine?
The canonical SMILES for tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine is CC(C)c1ccc(Cn2ccnc2)cc1.CC(C)c1ccc(N2CCOCC2)cc1.CC(C)c1ccc(OCC2CCCN2)cc1.CC(C)c1ccc(OCC2CCCN2C(=O)OC(C)(C)C)cc1.CC(C)c1ccc(OCC2CCNCC2)cc1.CC(C)c1ccc(OCCCCN)cc1.CC(C)c1ccc(OCCN2CCCCC2)cc1.CC(C)c1ccc(OCCc2ccccn2)cc1.CC(C)c1cccc(OCCN2CCOCC2)c1.CC(C)c1ccccc1O.COCCNCc1ccc(C(C)C)cc1.
What is the InChIKey of tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine?
The InChIKey is IAZRVRWVIJIKEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO3.C16H19NO.C16H25NO.C15H23NO2.C15H23NO.C14H21NO.C13H16N2.C13H19NO.2C13H21NO.C9H12O/c1-14(2)15-8-10-17(11-9-15)22-13-16-7-6-12-20(16)18(21)23-19(3,4)5;1-13(2)14-6-8-16(9-7-14)18-12-10-15-5-3-4-11-17-15;1-14(2)15-6-8-16(9-7-15)18-13-12-17-10-4-3-5-11-17;1-13(2)14-4-3-5-15(12-14)18-11-8-16-6-9-17-10-7-16;1-12(2)14-3-5-15(6-4-14)17-11-13-7-9-16-10-8-13;1-11(2)12-5-7-14(8-6-12)16-10-13-4-3-9-15-13;1-11(2)13-5-3-12(4-6-13)9-15-8-7-14-10-15;1-11(2)12-3-5-13(6-4-12)14-7-9-15-10-8-14;1-11(2)13-6-4-12(5-7-13)10-14-8-9-15-3;1-11(2)12-5-7-13(8-6-12)15-10-4-3-9-14;1-7(2)8-5-3-4-6-9(8)10/h8-11,14,16H,6-7,12-13H2,1-5H3;3-9,11,13H,10,12H2,1-2H3;6-9,14H,3-5,10-13H2,1-2H3;3-5,12-13H,6-11H2,1-2H3;3-6,12-13,16H,7-11H2,1-2H3;5-8,11,13,15H,3-4,9-10H2,1-2H3;3-8,10-11H,9H2,1-2H3;3-6,11H,7-10H2,1-2H3;4-7,11,14H,8-10H2,1-3H3;5-8,11H,3-4,9-10,14H2,1-2H3;3-7,10H,1-2H3.
What are the key properties of tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine?
tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine has a molecular weight of 2466.61 g/mol, XLogP of 34.43, 45 rotatable bonds, 5 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine-1-carboxylate;2-methoxy-N-[(4-propan-2-ylphenyl)methyl]ethanamine;2-propan-2-ylphenol;4-(4-propan-2-ylphenoxy)butan-1-amine;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(4-propan-2-ylphenoxy)ethyl]piperidine;2-[2-(4-propan-2-ylphenoxy)ethyl]pyridine;4-[(4-propan-2-ylphenoxy)methyl]piperidine;2-[(4-propan-2-ylphenoxy)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]imidazole;4-(4-propan-2-ylphenyl)morpholine is sourced from PubChem (CID 158646231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).