N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine

C85H60Cl3F6N17O10 — CID 162195096

IUPACN-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine
SMILESCC(F)(F)C(F)(F)Oc1cccc(Nc2noc3cccnc23)c1.CC1(F)Oc2ccc(Nc3noc4cccnc34)cc2O1.Cc1ccc(Oc2ccc(Nc3noc4cccnc34)cc2Cl)nc1.Clc1cccc(Nc2coc3cccnc23)c1.Fc1ccc2onc(Nc3cccc(Cl)c3)c2n1.c1ccc(Nc2coc3cccnc23)cc1
InChIInChI=1S/C18H13ClN4O2.C15H11F4N3O2.C14H10FN3O3.C13H9ClN2O.C13H10N2O.C12H7ClFN3O/c1-11-4-7-16(21-10-11)24-14-6-5-12(9-13(14)19)22-18-17-15(25-23-18)3-2-8-20-17;1-14(16,17)15(18,19)23-10-5-2-4-9(8-10)21-13-12-11(24-22-13)6-3-7-20-12;1-14(15)19-9-5-4-8(7-11(9)20-14)17-13-12-10(21-18-13)3-2-6-16-12;14-9-3-1-4-10(7-9)16-11-8-17-12-5-2-6-15-13(11)12;1-2-5-10(6-3-1)15-11-9-16-12-7-4-8-14-13(11)12;13-7-2-1-3-8(6-7)15-12-11-9(18-17-12)4-5-10(14)16-11/h2-10H,1H3,(H,22,23);2-8H,1H3,(H,21,22);2-7H,1H3,(H,17,18);1-8,16H;1-9,15H;1-6H,(H,15,17)
InChIKeyZQVHLDIWHSFEIZ-UHFFFAOYSA-N
MW1699.87 g/mol
LogP24.64
Rot. Bonds17

About N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine

N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine (PubChem CID 162195096) has the molecular formula C85H60Cl3F6N17O10 and a molecular weight of 1699.87 g/mol. Its IUPAC name is N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine.

Molecular Properties

Compound NameN-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine
PubChem CID162195096
Molecular FormulaC85H60Cl3F6N17O10
Molecular Weight1699.87 g/mol
Exact Mass1697.37
IUPAC NameN-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine
SMILESCC(F)(F)C(F)(F)Oc1cccc(Nc2noc3cccnc23)c1.CC1(F)Oc2ccc(Nc3noc4cccnc34)cc2O1.Cc1ccc(Oc2ccc(Nc3noc4cccnc34)cc2Cl)nc1.Clc1cccc(Nc2coc3cccnc23)c1.Fc1ccc2onc(Nc3cccc(Cl)c3)c2n1.c1ccc(Nc2coc3cccnc23)cc1
InChIInChI=1S/C18H13ClN4O2.C15H11F4N3O2.C14H10FN3O3.C13H9ClN2O.C13H10N2O.C12H7ClFN3O/c1-11-4-7-16(21-10-11)24-14-6-5-12(9-13(14)19)22-18-17-15(25-23-18)3-2-8-20-17;1-14(16,17)15(18,19)23-10-5-2-4-9(8-10)21-13-12-11(24-22-13)6-3-7-20-12;1-14(15)19-9-5-4-8(7-11(9)20-14)17-13-12-10(21-18-13)3-2-6-16-12;14-9-3-1-4-10(7-9)16-11-8-17-12-5-2-6-15-13(11)12;1-2-5-10(6-3-1)15-11-9-16-12-7-4-8-14-13(11)12;13-7-2-1-3-8(6-7)15-12-11-9(18-17-12)4-5-10(14)16-11/h2-10H,1H3,(H,22,23);2-8H,1H3,(H,21,22);2-7H,1H3,(H,17,18);1-8,16H;1-9,15H;1-6H,(H,15,17)
InChIKeyZQVHLDIWHSFEIZ-UHFFFAOYSA-N
XLogP24.64
TPSA329.73 Ų
H-Bond Donors6
H-Bond Acceptors27
Rotatable Bonds17
Heavy Atoms121
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001699.87
LogP ≤ 524.64
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Analyze N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine with MolForge

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

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Related Compounds

N-[3-(trifluoromethyl)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine
CID 53375004
7-fluoro-N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-1,2-benzoxazol-3-amine
CID 89459643
N-(1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine
CID 53375206
5-N-(3-chlorophenyl)-6-N-[3-(trifluoromethoxy)phenyl]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
CID 169155527
N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-4-methylbenzamide
CID 40541033
N-[4-[(5-methyl-2-pyridinyl)oxy]phenyl]-1-benzofuran-3-carboxamide
CID 86946761
2-N,4-N-bis(2-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3-chlorophenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(2,5-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;2-N,4-N-bis(3,4-dimethylphenyl)-5-fluoropyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(2-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(4-methoxyphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-bis(3-methylphenyl)pyrimidine-2,4-diamine;5-fluoro-2-N,4-N-diphenylpyrimidine-2,4-diamine
CID 160912926
5-chloro-2-N-(4-methylphenyl)-4-N-[3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 156768832
6-N-(3-chloro-4-fluorophenyl)-4-N-quinolin-8-ylpyrimidine-4,5,6-triamine
CID 19144805
4-N-(1-benzothiophen-3-yl)-2-N-tert-butyl-5-methylpyrimidine-2,4-diamine;2-N-tert-butyl-4-N-(4-chloro-3-fluorophenyl)-5-methylpyrimidine-2,4-diamine;2-N-tert-butyl-4-N-(4-chloro-3-methylphenyl)-5-methylpyrimidine-2,4-diamine;2-N-tert-butyl-4-N-(3-chlorophenyl)-5-methylpyrimidine-2,4-diamine;2-N-tert-butyl-5-methyl-4-N-(4-methylphenyl)pyrimidine-2,4-diamine;2-N-tert-butyl-5-methyl-4-N-phenylpyrimidine-2,4-diamine;2-N-tert-butyl-5-methyl-4-N-pyridin-3-ylpyrimidine-2,4-diamine
CID 161074654
8-chloro-N-(2,2-difluoro-1,3-benzodioxol-5-yl)quinazolin-2-amine
CID 177312618
N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride
CID 44641711

Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine?
The IUPAC name of N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine (CID 162195096) is N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine.
What is the SMILES notation for N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine?
The canonical SMILES for N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine is CC(F)(F)C(F)(F)Oc1cccc(Nc2noc3cccnc23)c1.CC1(F)Oc2ccc(Nc3noc4cccnc34)cc2O1.Cc1ccc(Oc2ccc(Nc3noc4cccnc34)cc2Cl)nc1.Clc1cccc(Nc2coc3cccnc23)c1.Fc1ccc2onc(Nc3cccc(Cl)c3)c2n1.c1ccc(Nc2coc3cccnc23)cc1.
What is the InChIKey of N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine?
The InChIKey is ZQVHLDIWHSFEIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13ClN4O2.C15H11F4N3O2.C14H10FN3O3.C13H9ClN2O.C13H10N2O.C12H7ClFN3O/c1-11-4-7-16(21-10-11)24-14-6-5-12(9-13(14)19)22-18-17-15(25-23-18)3-2-8-20-17;1-14(16,17)15(18,19)23-10-5-2-4-9(8-10)21-13-12-11(24-22-13)6-3-7-20-12;1-14(15)19-9-5-4-8(7-11(9)20-14)17-13-12-10(21-18-13)3-2-6-16-12;14-9-3-1-4-10(7-9)16-11-8-17-12-5-2-6-15-13(11)12;1-2-5-10(6-3-1)15-11-9-16-12-7-4-8-14-13(11)12;13-7-2-1-3-8(6-7)15-12-11-9(18-17-12)4-5-10(14)16-11/h2-10H,1H3,(H,22,23);2-8H,1H3,(H,21,22);2-7H,1H3,(H,17,18);1-8,16H;1-9,15H;1-6H,(H,15,17).
What are the key properties of N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine?
N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine has a molecular weight of 1699.87 g/mol, XLogP of 24.64, 17 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-4-[(5-methyl-2-pyridinyl)oxy]phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)-5-fluoro-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-(3-chlorophenyl)furo[3,2-b]pyridin-3-amine;N-(2-fluoro-2-methyl-1,3-benzodioxol-5-yl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;N-phenylfuro[3,2-b]pyridin-3-amine;N-[3-(1,1,2,2-tetrafluoropropoxy)phenyl]-[1,2]oxazolo[4,5-b]pyridin-3-amine is sourced from PubChem (CID 162195096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).