2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol

C134H276N24O27 — CID 158629136

IUPAC2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol
SMILESCCC(C)C(N)CO.CCC(N)CO.CCN(CC)Cc1cc(N)ccc1O.CN(C)CC(O)CN(C)C.CN(C)CCN(C)CCO.CN(C)CCO.CN(C)CCOCCO.CN(CCO)CCO.CN1CCC(O)C1.COc1cc(C(O)CN)ccc1O.COc1cc(CCN)ccc1O.NC(CO)CO.NC1CCC(O)CC1.NC1CCCCC1O.NCCCCO.OC1CCN(Cc2ccccc2)CC1.OCC1CCCNC1.OCCN1CCCC1.OCCNCCNCCO.Oc1ccc2c3c1CCCN3CCC2
InChIInChI=1S/C12H15NO.C12H17NO.C11H18N2O.C9H13NO3.C9H13NO2.2C7H18N2O.C6H16N2O2.C6H15NO2.4C6H13NO.C6H15NO.C5H13NO2.C5H11NO.3C4H11NO.C3H9NO2/c14-11-6-5-9-3-1-7-13-8-2-4-10(11)12(9)13;14-12-6-8-13(9-7-12)10-11-4-2-1-3-5-11;1-3-13(4-2)8-9-7-10(12)5-6-11(9)14;1-13-9-4-6(8(12)5-10)2-3-7(9)11;1-12-9-6-7(4-5-10)2-3-8(9)11;1-8(2)5-7(10)6-9(3)4;1-8(2)4-5-9(3)6-7-10;9-5-3-7-1-2-8-4-6-10;1-7(2)3-5-9-6-4-8;7-5-1-3-6(8)4-2-5;8-5-6-2-1-3-7-4-6;8-6-5-7-3-1-2-4-7;7-5-3-1-2-4-6(5)8;1-3-5(2)6(7)4-8;1-6(2-4-7)3-5-8;1-6-3-2-5(7)4-6;1-5(2)3-4-6;1-2-4(5)3-6;5-3-1-2-4-6;4-3(1-5)2-6/h5-6,14H,1-4,7-8H2;1-5,12,14H,6-10H2;5-7,14H,3-4,8,12H2,1-2H3;2-4,8,11-12H,5,10H2,1H3;2-3,6,11H,4-5,10H2,1H3;7,10H,5-6H2,1-4H3;10H,4-7H2,1-3H3;7-10H,1-6H2;8H,3-6H2,1-2H3;5-6,8H,1-4,7H2;6-8H,1-5H2;8H,1-6H2;5-6,8H,1-4,7H2;5-6,8H,3-4,7H2,1-2H3;7-8H,2-5H2,1H3;5,7H,2-4H2,1H3;6H,3-4H2,1-2H3;4,6H,2-3,5H2,1H3;6H,1-5H2;3,5-6H,1-2,4H2
InChIKeyHYYYFFCPXHXIHT-UHFFFAOYSA-N
MW2655.82 g/mol
LogP0.25
Rot. Bonds52

About 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol

2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol (PubChem CID 158629136) has the molecular formula C134H276N24O27 and a molecular weight of 2655.82 g/mol. Its IUPAC name is 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol.

Molecular Properties

Compound Name2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol
PubChem CID158629136
Molecular FormulaC134H276N24O27
Molecular Weight2655.82 g/mol
Exact Mass2654.10
IUPAC Name2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol
SMILESCCC(C)C(N)CO.CCC(N)CO.CCN(CC)Cc1cc(N)ccc1O.CN(C)CC(O)CN(C)C.CN(C)CCN(C)CCO.CN(C)CCO.CN(C)CCOCCO.CN(CCO)CCO.CN1CCC(O)C1.COc1cc(C(O)CN)ccc1O.COc1cc(CCN)ccc1O.NC(CO)CO.NC1CCC(O)CC1.NC1CCCCC1O.NCCCCO.OC1CCN(Cc2ccccc2)CC1.OCC1CCCNC1.OCCN1CCCC1.OCCNCCNCCO.Oc1ccc2c3c1CCCN3CCC2
InChIInChI=1S/C12H15NO.C12H17NO.C11H18N2O.C9H13NO3.C9H13NO2.2C7H18N2O.C6H16N2O2.C6H15NO2.4C6H13NO.C6H15NO.C5H13NO2.C5H11NO.3C4H11NO.C3H9NO2/c14-11-6-5-9-3-1-7-13-8-2-4-10(11)12(9)13;14-12-6-8-13(9-7-12)10-11-4-2-1-3-5-11;1-3-13(4-2)8-9-7-10(12)5-6-11(9)14;1-13-9-4-6(8(12)5-10)2-3-7(9)11;1-12-9-6-7(4-5-10)2-3-8(9)11;1-8(2)5-7(10)6-9(3)4;1-8(2)4-5-9(3)6-7-10;9-5-3-7-1-2-8-4-6-10;1-7(2)3-5-9-6-4-8;7-5-1-3-6(8)4-2-5;8-5-6-2-1-3-7-4-6;8-6-5-7-3-1-2-4-7;7-5-3-1-2-4-6(5)8;1-3-5(2)6(7)4-8;1-6(2-4-7)3-5-8;1-6-3-2-5(7)4-6;1-5(2)3-4-6;1-2-4(5)3-6;5-3-1-2-4-6;4-3(1-5)2-6/h5-6,14H,1-4,7-8H2;1-5,12,14H,6-10H2;5-7,14H,3-4,8,12H2,1-2H3;2-4,8,11-12H,5,10H2,1H3;2-3,6,11H,4-5,10H2,1H3;7,10H,5-6H2,1-4H3;10H,4-7H2,1-3H3;7-10H,1-6H2;8H,3-6H2,1-2H3;5-6,8H,1-4,7H2;6-8H,1-5H2;8H,1-6H2;5-6,8H,1-4,7H2;5-6,8H,3-4,7H2,1-2H3;7-8H,2-5H2,1H3;5,7H,2-4H2,1H3;6H,3-4H2,1-2H3;4,6H,2-3,5H2,1H3;6H,1-5H2;3,5-6H,1-2,4H2
InChIKeyHYYYFFCPXHXIHT-UHFFFAOYSA-N
XLogP0.25
TPSA822.36 Ų
H-Bond Donors36
H-Bond Acceptors51
Rotatable Bonds52
Heavy Atoms185
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002655.82
LogP ≤ 50.25
H-Bond Donors ≤ 536
H-Bond Acceptors ≤ 1051

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol with MolForge

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Related Compounds

2-aminobutan-1-ol;4-aminobutan-1-ol;1-amino-2,3-dihydro-1H-inden-2-ol;5-(2-aminoethyl)benzene-1,2,4-triol;4-(2-amino-1-hydroxypropyl)benzene-1,2-diol;2-amino-2-methylpropan-1-ol;5-aminopentan-1-ol;1-benzylpyrrolidin-3-ol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol;4-[1-hydroxy-2-(methylamino)ethyl]-2-methoxyphenol;4-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol;4-phenylpiperidin-4-ol;pyrrolidin-3-ol;3-pyrrolidin-1-ylpropane-1,2-diol
CID 160818803
1-benzyl-2,5-dihydropyrrole;1-benzylpyrrolidine;1-benzylpyrrolidin-3-ol;1-but-3-enylpyrrolidine;1-butylpyrrolidine;1-ethylpyrrolidine;1-ethylpyrrolidin-3-ol;1-methylpyrrolidine;1-methylpyrrolidin-3-ol;1-pentylpyrrolidine;2-pyrrolidin-1-ylethanol;3-pyrrolidin-1-ylpropane-1,2-diol
CID 159312532
(3R)-N,N-diethyl-1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidine-3-carboxamide
CID 40501214
2-methoxy-4-[3-(3-piperidin-1-ylpropoxy)propyl]phenol
CID 11978505
4-[[3-(4-benzylpiperazin-1-yl)propylamino]methyl]-2-methoxyphenol
CID 118727082
4-[3-(4-benzylpiperidin-1-yl)butyl]-2-methoxyphenol;ethane
CID 144539907
1-(1-benzylpiperidin-4-yl)-3-ethyl-2-[2-(4-hydroxy-3-methoxyphenyl)ethyl]guanidine
CID 111548877
1-[(3S)-1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-3-yl]-2-phenylethanone
CID 95888911
3-(1-benzylpiperidin-4-yl)-1-[4-[3-(dimethylamino)-1-(2-methoxyphenoxy)propyl]phenyl]propan-1-one
CID 139836303
2-[[4-[4-[[4-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]phenyl]methyl]piperazin-1-yl]-2-methylbutan-2-yl]disulfanyl]ethyl N-[(2S)-1-[[(2S)-1-[[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-N-methylcarbamate
CID 146512042
4-(4-benzylpiperazin-1-yl)-3-methoxyaniline
CID 129452213
4-[[[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]methyl-methylamino]methyl]-2-methoxyphenol
CID 26406188

Frequently Asked Questions

What is the IUPAC name of 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol?
The IUPAC name of 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol (CID 158629136) is 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol.
What is the SMILES notation for 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol?
The canonical SMILES for 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol is CCC(C)C(N)CO.CCC(N)CO.CCN(CC)Cc1cc(N)ccc1O.CN(C)CC(O)CN(C)C.CN(C)CCN(C)CCO.CN(C)CCO.CN(C)CCOCCO.CN(CCO)CCO.CN1CCC(O)C1.COc1cc(C(O)CN)ccc1O.COc1cc(CCN)ccc1O.NC(CO)CO.NC1CCC(O)CC1.NC1CCCCC1O.NCCCCO.OC1CCN(Cc2ccccc2)CC1.OCC1CCCNC1.OCCN1CCCC1.OCCNCCNCCO.Oc1ccc2c3c1CCCN3CCC2.
What is the InChIKey of 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol?
The InChIKey is HYYYFFCPXHXIHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO.C12H17NO.C11H18N2O.C9H13NO3.C9H13NO2.2C7H18N2O.C6H16N2O2.C6H15NO2.4C6H13NO.C6H15NO.C5H13NO2.C5H11NO.3C4H11NO.C3H9NO2/c14-11-6-5-9-3-1-7-13-8-2-4-10(11)12(9)13;14-12-6-8-13(9-7-12)10-11-4-2-1-3-5-11;1-3-13(4-2)8-9-7-10(12)5-6-11(9)14;1-13-9-4-6(8(12)5-10)2-3-7(9)11;1-12-9-6-7(4-5-10)2-3-8(9)11;1-8(2)5-7(10)6-9(3)4;1-8(2)4-5-9(3)6-7-10;9-5-3-7-1-2-8-4-6-10;1-7(2)3-5-9-6-4-8;7-5-1-3-6(8)4-2-5;8-5-6-2-1-3-7-4-6;8-6-5-7-3-1-2-4-7;7-5-3-1-2-4-6(5)8;1-3-5(2)6(7)4-8;1-6(2-4-7)3-5-8;1-6-3-2-5(7)4-6;1-5(2)3-4-6;1-2-4(5)3-6;5-3-1-2-4-6;4-3(1-5)2-6/h5-6,14H,1-4,7-8H2;1-5,12,14H,6-10H2;5-7,14H,3-4,8,12H2,1-2H3;2-4,8,11-12H,5,10H2,1H3;2-3,6,11H,4-5,10H2,1H3;7,10H,5-6H2,1-4H3;10H,4-7H2,1-3H3;7-10H,1-6H2;8H,3-6H2,1-2H3;5-6,8H,1-4,7H2;6-8H,1-5H2;8H,1-6H2;5-6,8H,1-4,7H2;5-6,8H,3-4,7H2,1-2H3;7-8H,2-5H2,1H3;5,7H,2-4H2,1H3;6H,3-4H2,1-2H3;4,6H,2-3,5H2,1H3;6H,1-5H2;3,5-6H,1-2,4H2.
What are the key properties of 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol?
2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol has a molecular weight of 2655.82 g/mol, XLogP of 0.25, 52 rotatable bonds, 36 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminobutan-1-ol;4-aminobutan-1-ol;2-aminocyclohexan-1-ol;4-aminocyclohexan-1-ol;4-amino-2-(diethylaminomethyl)phenol;4-(2-aminoethyl)-2-methoxyphenol;4-(2-amino-1-hydroxyethyl)-2-methoxyphenol;2-amino-3-methylpentan-1-ol;2-aminopropane-1,3-diol;1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol;1-benzylpiperidin-4-ol;1,3-bis(dimethylamino)propan-2-ol;2-(dimethylamino)ethanol;2-[2-(dimethylamino)ethoxy]ethanol;2-[2-(dimethylamino)ethyl-methylamino]ethanol;2-[2-(2-hydroxyethylamino)ethylamino]ethanol;2-[2-hydroxyethyl(methyl)amino]ethanol;1-methylpyrrolidin-3-ol;piperidin-3-ylmethanol;2-pyrrolidin-1-ylethanol is sourced from PubChem (CID 158629136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).