5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate

C75H83BBr3F8N21O10 — CID 159373977

IUPAC5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate
SMILESC1CCOC1.CC1(C)OB(c2ccc(N)nc2)OC1(C)C.COC(OC)N(C)C.Cc1cc(/N=C/NO)ncc1Br.Cc1cc(N)ncc1Br.Cc1cc2ncnn2cc1-c1ccc(N)nc1.Cc1cc2ncnn2cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.Cc1cc2ncnn2cc1Br.O=C(OC(=O)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C19H13F2N5O.C12H11N5.C11H17BN2O2.C7H8BrN3O.C7H6BrN3.C6H7BrN2.C5H13NO2.C4F6O3.C4H8O/c1-11-7-17-23-10-24-26(17)9-13(11)12-5-6-16(22-8-12)25-19(27)18-14(20)3-2-4-15(18)21;1-8-4-12-15-7-16-17(12)6-10(8)9-2-3-11(13)14-5-9;1-10(2)11(3,4)16-12(15-10)8-5-6-9(13)14-7-8;1-5-2-7(10-4-11-12)9-3-6(5)8;1-5-2-7-9-4-10-11(7)3-6(5)8;1-4-2-6(8)9-3-5(4)7;1-6(2)5(7-3)8-4;5-3(6,7)1(11)13-2(12)4(8,9)10;1-2-4-5-3-1/h2-10H,1H3,(H,22,25,27);2-7H,1H3,(H2,13,14);5-7H,1-4H3,(H2,13,14);2-4,12H,1H3,(H,9,10,11);2-4H,1H3;2-3H,1H3,(H2,8,9);5H,1-4H3;;1-4H2
InChIKeyLKBUFHURSGOTFN-UHFFFAOYSA-N
MW1841.13 g/mol
LogP13.70
Rot. Bonds10

About 5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate

5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate (PubChem CID 159373977) has the molecular formula C75H83BBr3F8N21O10 and a molecular weight of 1841.13 g/mol. Its IUPAC name is 5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate.

Molecular Properties

Compound Name5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate
PubChem CID159373977
Molecular FormulaC75H83BBr3F8N21O10
Molecular Weight1841.13 g/mol
Exact Mass1837.41
IUPAC Name5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate
SMILESC1CCOC1.CC1(C)OB(c2ccc(N)nc2)OC1(C)C.COC(OC)N(C)C.Cc1cc(/N=C/NO)ncc1Br.Cc1cc(N)ncc1Br.Cc1cc2ncnn2cc1-c1ccc(N)nc1.Cc1cc2ncnn2cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.Cc1cc2ncnn2cc1Br.O=C(OC(=O)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C19H13F2N5O.C12H11N5.C11H17BN2O2.C7H8BrN3O.C7H6BrN3.C6H7BrN2.C5H13NO2.C4F6O3.C4H8O/c1-11-7-17-23-10-24-26(17)9-13(11)12-5-6-16(22-8-12)25-19(27)18-14(20)3-2-4-15(18)21;1-8-4-12-15-7-16-17(12)6-10(8)9-2-3-11(13)14-5-9;1-10(2)11(3,4)16-12(15-10)8-5-6-9(13)14-7-8;1-5-2-7(10-4-11-12)9-3-6(5)8;1-5-2-7-9-4-10-11(7)3-6(5)8;1-4-2-6(8)9-3-5(4)7;1-6(2)5(7-3)8-4;5-3(6,7)1(11)13-2(12)4(8,9)10;1-2-4-5-3-1/h2-10H,1H3,(H,22,25,27);2-7H,1H3,(H2,13,14);5-7H,1-4H3,(H2,13,14);2-4,12H,1H3,(H,9,10,11);2-4H,1H3;2-3H,1H3,(H2,8,9);5H,1-4H3;;1-4H2
InChIKeyLKBUFHURSGOTFN-UHFFFAOYSA-N
XLogP13.70
TPSA399.56 Ų
H-Bond Donors6
H-Bond Acceptors29
Rotatable Bonds10
Heavy Atoms118
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001841.13
LogP ≤ 513.70
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate with MolForge

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Related Compounds

5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate
CID 158539900

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate?
The IUPAC name of 5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate (CID 159373977) is 5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate.
What is the SMILES notation for 5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate?
The canonical SMILES for 5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate is C1CCOC1.CC1(C)OB(c2ccc(N)nc2)OC1(C)C.COC(OC)N(C)C.Cc1cc(/N=C/NO)ncc1Br.Cc1cc(N)ncc1Br.Cc1cc2ncnn2cc1-c1ccc(N)nc1.Cc1cc2ncnn2cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.Cc1cc2ncnn2cc1Br.O=C(OC(=O)C(F)(F)F)C(F)(F)F.
What is the InChIKey of 5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate?
The InChIKey is LKBUFHURSGOTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F2N5O.C12H11N5.C11H17BN2O2.C7H8BrN3O.C7H6BrN3.C6H7BrN2.C5H13NO2.C4F6O3.C4H8O/c1-11-7-17-23-10-24-26(17)9-13(11)12-5-6-16(22-8-12)25-19(27)18-14(20)3-2-4-15(18)21;1-8-4-12-15-7-16-17(12)6-10(8)9-2-3-11(13)14-5-9;1-10(2)11(3,4)16-12(15-10)8-5-6-9(13)14-7-8;1-5-2-7(10-4-11-12)9-3-6(5)8;1-5-2-7-9-4-10-11(7)3-6(5)8;1-4-2-6(8)9-3-5(4)7;1-6(2)5(7-3)8-4;5-3(6,7)1(11)13-2(12)4(8,9)10;1-2-4-5-3-1/h2-10H,1H3,(H,22,25,27);2-7H,1H3,(H2,13,14);5-7H,1-4H3,(H2,13,14);2-4,12H,1H3,(H,9,10,11);2-4H,1H3;2-3H,1H3,(H2,8,9);5H,1-4H3;;1-4H2.
What are the key properties of 5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate?
5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate has a molecular weight of 1841.13 g/mol, XLogP of 13.70, 10 rotatable bonds, 6 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-methylpyridin-2-amine;N'-(5-bromo-4-methyl-2-pyridinyl)-N-hydroxymethanimidamide;6-bromo-7-methyl-[1,2,4]triazolo[1,5-a]pyridine;2,6-difluoro-N-[5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-pyridinyl]benzamide;1,1-dimethoxy-N,N-dimethylmethanamine;5-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyridin-2-amine;oxolane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine;(2,2,2-trifluoroacetyl) 2,2,2-trifluoroacetate is sourced from PubChem (CID 159373977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).