4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol

C140H189Cl2N17O22 — CID 160681780

IUPAC4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol
SMILESCC(C)N(C)CC(O)c1ccc(O)cc1.CC1CCCC(C)N1CC(O)c1ccc(O)cc1.CCCC(C)(C)NCC(O)c1ccc(O)cc1.CCCN(CCC)CC(O)c1ccc(O)cc1.Cc1cc(C)cc(CNCC(O)c2ccc(O)cc2)c1.Cc1cc(C)nc(NCC(O)c2ccc(O)cc2)n1.Cc1ccccc1NCC(O)c1ccc(O)cc1.O=[N+]([O-])c1ccc(NCC(O)c2ccc(O)cc2)nc1.Oc1ccc(C(O)CNCCN2CCCC2)cc1.Oc1ccc(C(O)CNc2nc(Cl)cc(Cl)n2)cc1
InChIInChI=1S/C17H21NO2.C15H23NO2.C15H17NO2.C14H17N3O2.C14H22N2O2.2C14H23NO2.C13H13N3O4.C12H11Cl2N3O2.C12H19NO2/c1-12-7-13(2)9-14(8-12)10-18-11-17(20)15-3-5-16(19)6-4-15;1-11-4-3-5-12(2)16(11)10-15(18)13-6-8-14(17)9-7-13;1-11-4-2-3-5-14(11)16-10-15(18)12-6-8-13(17)9-7-12;1-9-7-10(2)17-14(16-9)15-8-13(19)11-3-5-12(18)6-4-11;17-13-5-3-12(4-6-13)14(18)11-15-7-10-16-8-1-2-9-16;1-4-9-14(2,3)15-10-13(17)11-5-7-12(16)8-6-11;1-3-9-15(10-4-2)11-14(17)12-5-7-13(16)8-6-12;17-11-4-1-9(2-5-11)12(18)8-15-13-6-3-10(7-14-13)16(19)20;13-10-5-11(14)17-12(16-10)15-6-9(19)7-1-3-8(18)4-2-7;1-9(2)13(3)8-12(15)10-4-6-11(14)7-5-10/h3-9,17-20H,10-11H2,1-2H3;6-9,11-12,15,17-18H,3-5,10H2,1-2H3;2-9,15-18H,10H2,1H3;3-7,13,18-19H,8H2,1-2H3,(H,15,16,17);3-6,14-15,17-18H,1-2,7-11H2;5-8,13,15-17H,4,9-10H2,1-3H3;5-8,14,16-17H,3-4,9-11H2,1-2H3;1-7,12,17-18H,8H2,(H,14,15);1-5,9,18-19H,6H2,(H,15,16,17);4-7,9,12,14-15H,8H2,1-3H3
InChIKeyROFXTOLDAUEEAM-UHFFFAOYSA-N
MW2533.05 g/mol
LogP22.81
Rot. Bonds48

About 4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol

4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol (PubChem CID 160681780) has the molecular formula C140H189Cl2N17O22 and a molecular weight of 2533.05 g/mol. Its IUPAC name is 4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol.

Molecular Properties

Compound Name4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol
PubChem CID160681780
Molecular FormulaC140H189Cl2N17O22
Molecular Weight2533.05 g/mol
Exact Mass2530.36
IUPAC Name4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol
SMILESCC(C)N(C)CC(O)c1ccc(O)cc1.CC1CCCC(C)N1CC(O)c1ccc(O)cc1.CCCC(C)(C)NCC(O)c1ccc(O)cc1.CCCN(CCC)CC(O)c1ccc(O)cc1.Cc1cc(C)cc(CNCC(O)c2ccc(O)cc2)c1.Cc1cc(C)nc(NCC(O)c2ccc(O)cc2)n1.Cc1ccccc1NCC(O)c1ccc(O)cc1.O=[N+]([O-])c1ccc(NCC(O)c2ccc(O)cc2)nc1.Oc1ccc(C(O)CNCCN2CCCC2)cc1.Oc1ccc(C(O)CNc2nc(Cl)cc(Cl)n2)cc1
InChIInChI=1S/C17H21NO2.C15H23NO2.C15H17NO2.C14H17N3O2.C14H22N2O2.2C14H23NO2.C13H13N3O4.C12H11Cl2N3O2.C12H19NO2/c1-12-7-13(2)9-14(8-12)10-18-11-17(20)15-3-5-16(19)6-4-15;1-11-4-3-5-12(2)16(11)10-15(18)13-6-8-14(17)9-7-13;1-11-4-2-3-5-14(11)16-10-15(18)12-6-8-13(17)9-7-12;1-9-7-10(2)17-14(16-9)15-8-13(19)11-3-5-12(18)6-4-11;17-13-5-3-12(4-6-13)14(18)11-15-7-10-16-8-1-2-9-16;1-4-9-14(2,3)15-10-13(17)11-5-7-12(16)8-6-11;1-3-9-15(10-4-2)11-14(17)12-5-7-13(16)8-6-12;17-11-4-1-9(2-5-11)12(18)8-15-13-6-3-10(7-14-13)16(19)20;13-10-5-11(14)17-12(16-10)15-6-9(19)7-1-3-8(18)4-2-7;1-9(2)13(3)8-12(15)10-4-6-11(14)7-5-10/h3-9,17-20H,10-11H2,1-2H3;6-9,11-12,15,17-18H,3-5,10H2,1-2H3;2-9,15-18H,10H2,1H3;3-7,13,18-19H,8H2,1-2H3,(H,15,16,17);3-6,14-15,17-18H,1-2,7-11H2;5-8,13,15-17H,4,9-10H2,1-3H3;5-8,14,16-17H,3-4,9-11H2,1-2H3;1-7,12,17-18H,8H2,(H,14,15);1-5,9,18-19H,6H2,(H,15,16,17);4-7,9,12,14-15H,8H2,1-3H3
InChIKeyROFXTOLDAUEEAM-UHFFFAOYSA-N
XLogP22.81
TPSA609.36 Ų
H-Bond Donors27
H-Bond Acceptors38
Rotatable Bonds48
Heavy Atoms181
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002533.05
LogP ≤ 522.81
H-Bond Donors ≤ 527
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol with MolForge

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Related Compounds

4-[2-[(4,6-Dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[1-hydroxy-2-[(6-methoxypyrimidin-4-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(6-methyl-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitropyrimidin-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-(pyridin-2-ylamino)ethyl]phenol
CID 157151610
4-(2-Anilino-1-hydroxyethyl)phenol;4-[2-[butyl(methyl)amino]-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(4-methylanilino)ethyl]phenol;4-[1-hydroxy-2-[(3-methyl-2,3-dihydro-1,2-thiazol-5-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(3-methyl-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-[(4-methyl-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-methyl-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-[(3-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(4-phenylanilino)ethyl]phenol;4-[1-hydroxy-2-(pyrimidin-2-ylamino)ethyl]phenol
CID 157416818
4-[2-(Cyclohex-2-en-1-ylamino)-1-hydroxyethyl]phenol;4-[2-(cyclohex-3-en-1-ylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(4-methylanilino)ethyl]phenol;4-[1-hydroxy-2-[(3-methylphenyl)methylamino]ethyl]phenol;4-[1-hydroxy-2-[(3-methyl-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-[(4-methyl-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-methyl-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-[(3-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-1,3-thiazol-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-(4-phenylanilino)ethyl]phenol;4-[1-hydroxy-2-(pyrimidin-2-ylamino)ethyl]phenol
CID 158013978
4-[2-[(4,6-Dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[1-hydroxy-2-[(6-methoxypyrimidin-4-yl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(pyridin-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol
CID 159670234

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol?
The IUPAC name of 4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol (CID 160681780) is 4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol.
What is the SMILES notation for 4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol?
The canonical SMILES for 4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol is CC(C)N(C)CC(O)c1ccc(O)cc1.CC1CCCC(C)N1CC(O)c1ccc(O)cc1.CCCC(C)(C)NCC(O)c1ccc(O)cc1.CCCN(CCC)CC(O)c1ccc(O)cc1.Cc1cc(C)cc(CNCC(O)c2ccc(O)cc2)c1.Cc1cc(C)nc(NCC(O)c2ccc(O)cc2)n1.Cc1ccccc1NCC(O)c1ccc(O)cc1.O=[N+]([O-])c1ccc(NCC(O)c2ccc(O)cc2)nc1.Oc1ccc(C(O)CNCCN2CCCC2)cc1.Oc1ccc(C(O)CNc2nc(Cl)cc(Cl)n2)cc1.
What is the InChIKey of 4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol?
The InChIKey is ROFXTOLDAUEEAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2.C15H23NO2.C15H17NO2.C14H17N3O2.C14H22N2O2.2C14H23NO2.C13H13N3O4.C12H11Cl2N3O2.C12H19NO2/c1-12-7-13(2)9-14(8-12)10-18-11-17(20)15-3-5-16(19)6-4-15;1-11-4-3-5-12(2)16(11)10-15(18)13-6-8-14(17)9-7-13;1-11-4-2-3-5-14(11)16-10-15(18)12-6-8-13(17)9-7-12;1-9-7-10(2)17-14(16-9)15-8-13(19)11-3-5-12(18)6-4-11;17-13-5-3-12(4-6-13)14(18)11-15-7-10-16-8-1-2-9-16;1-4-9-14(2,3)15-10-13(17)11-5-7-12(16)8-6-11;1-3-9-15(10-4-2)11-14(17)12-5-7-13(16)8-6-12;17-11-4-1-9(2-5-11)12(18)8-15-13-6-3-10(7-14-13)16(19)20;13-10-5-11(14)17-12(16-10)15-6-9(19)7-1-3-8(18)4-2-7;1-9(2)13(3)8-12(15)10-4-6-11(14)7-5-10/h3-9,17-20H,10-11H2,1-2H3;6-9,11-12,15,17-18H,3-5,10H2,1-2H3;2-9,15-18H,10H2,1H3;3-7,13,18-19H,8H2,1-2H3,(H,15,16,17);3-6,14-15,17-18H,1-2,7-11H2;5-8,13,15-17H,4,9-10H2,1-3H3;5-8,14,16-17H,3-4,9-11H2,1-2H3;1-7,12,17-18H,8H2,(H,14,15);1-5,9,18-19H,6H2,(H,15,16,17);4-7,9,12,14-15H,8H2,1-3H3.
What are the key properties of 4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol?
4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol has a molecular weight of 2533.05 g/mol, XLogP of 22.81, 48 rotatable bonds, 27 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(4,6-dichloropyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-[(3,5-dimethylphenyl)methylamino]-1-hydroxyethyl]phenol;4-[2-(2,6-dimethylpiperidin-1-yl)-1-hydroxyethyl]phenol;4-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-hydroxyethyl]phenol;4-[2-(dipropylamino)-1-hydroxyethyl]phenol;4-[1-hydroxy-2-(2-methylanilino)ethyl]phenol;4-[1-hydroxy-2-(2-methylpentan-2-ylamino)ethyl]phenol;4-[1-hydroxy-2-[methyl(propan-2-yl)amino]ethyl]phenol;4-[1-hydroxy-2-[(5-nitro-2-pyridinyl)amino]ethyl]phenol;4-[1-hydroxy-2-(2-pyrrolidin-1-ylethylamino)ethyl]phenol is sourced from PubChem (CID 160681780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).