6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine

C96H115N33O3S4 — CID 157056431

IUPAC6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine
SMILESCC(C)c1ccc(-c2cc(N)on2)nc1.CC(C)c1ccc(-c2cccnc2N)nc1.CC(C)c1ccc(-c2nc(N)no2)cn1.CC(C)c1cn(-c2cccc(N)n2)cn1.CC(C)c1cnc(-c2nc(N)cs2)cn1.CC(C)c1cnc(-c2nccc(N)n2)s1.CC(C)c1ncc(-c2cccc(N)n2)o1.CC(C)c1ncc(-c2nc(N)cs2)cn1.CC(C)c1nnc(-c2cccc(N)n2)s1
InChIInChI=1S/C13H15N3.C11H14N4.2C11H13N3O.C10H12N4O.4C10H12N4S/c1-9(2)10-5-6-12(16-8-10)11-4-3-7-15-13(11)14;1-8(2)9-6-15(7-13-9)11-5-3-4-10(12)14-11;1-7(2)8-3-4-9(13-6-8)10-5-11(12)15-14-10;1-7(2)11-13-6-9(15-11)8-4-3-5-10(12)14-8;1-6(2)8-4-3-7(5-12-8)9-13-10(11)14-15-9;1-6(2)7-3-13-8(4-12-7)10-14-9(11)5-15-10;1-6(2)9-12-3-7(4-13-9)10-14-8(11)5-15-10;1-6(2)7-5-13-10(15-7)9-12-4-3-8(11)14-9;1-6(2)9-13-14-10(15-9)7-4-3-5-8(11)12-7/h3-9H,1-2H3,(H2,14,15);3-8H,1-2H3,(H2,12,14);3-7H,12H2,1-2H3;3-7H,1-2H3,(H2,12,14);3-6H,1-2H3,(H2,11,14);2*3-6H,11H2,1-2H3;3-6H,1-2H3,(H2,11,12,14);3-6H,1-2H3,(H2,11,12)
InChIKeyAAUSNBILLPDIKC-UHFFFAOYSA-N
MW1907.47 g/mol
LogP20.77
Rot. Bonds18

About 6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine

6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine (PubChem CID 157056431) has the molecular formula C96H115N33O3S4 and a molecular weight of 1907.47 g/mol. Its IUPAC name is 6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine
PubChem CID157056431
Molecular FormulaC96H115N33O3S4
Molecular Weight1907.47 g/mol
Exact Mass1905.87
IUPAC Name6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine
SMILESCC(C)c1ccc(-c2cc(N)on2)nc1.CC(C)c1ccc(-c2cccnc2N)nc1.CC(C)c1ccc(-c2nc(N)no2)cn1.CC(C)c1cn(-c2cccc(N)n2)cn1.CC(C)c1cnc(-c2nc(N)cs2)cn1.CC(C)c1cnc(-c2nccc(N)n2)s1.CC(C)c1ncc(-c2cccc(N)n2)o1.CC(C)c1ncc(-c2nc(N)cs2)cn1.CC(C)c1nnc(-c2cccc(N)n2)s1
InChIInChI=1S/C13H15N3.C11H14N4.2C11H13N3O.C10H12N4O.4C10H12N4S/c1-9(2)10-5-6-12(16-8-10)11-4-3-7-15-13(11)14;1-8(2)9-6-15(7-13-9)11-5-3-4-10(12)14-11;1-7(2)8-3-4-9(13-6-8)10-5-11(12)15-14-10;1-7(2)11-13-6-9(15-11)8-4-3-5-10(12)14-8;1-6(2)8-4-3-7(5-12-8)9-13-10(11)14-15-9;1-6(2)7-3-13-8(4-12-7)10-14-9(11)5-15-10;1-6(2)9-12-3-7(4-13-9)10-14-8(11)5-15-10;1-6(2)7-5-13-10(15-7)9-12-4-3-8(11)14-9;1-6(2)9-13-14-10(15-9)7-4-3-5-8(11)12-7/h3-9H,1-2H3,(H2,14,15);3-8H,1-2H3,(H2,12,14);3-7H,12H2,1-2H3;3-7H,1-2H3,(H2,12,14);3-6H,1-2H3,(H2,11,14);2*3-6H,11H2,1-2H3;3-6H,1-2H3,(H2,11,12,14);3-6H,1-2H3,(H2,11,12)
InChIKeyAAUSNBILLPDIKC-UHFFFAOYSA-N
XLogP20.77
TPSA575.00 Ų
H-Bond Donors9
H-Bond Acceptors40
Rotatable Bonds18
Heavy Atoms136
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001907.47
LogP ≤ 520.77
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1040

Analyze 6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine?
The IUPAC name of 6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine (CID 157056431) is 6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine?
The canonical SMILES for 6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine is CC(C)c1ccc(-c2cc(N)on2)nc1.CC(C)c1ccc(-c2cccnc2N)nc1.CC(C)c1ccc(-c2nc(N)no2)cn1.CC(C)c1cn(-c2cccc(N)n2)cn1.CC(C)c1cnc(-c2nc(N)cs2)cn1.CC(C)c1cnc(-c2nccc(N)n2)s1.CC(C)c1ncc(-c2cccc(N)n2)o1.CC(C)c1ncc(-c2nc(N)cs2)cn1.CC(C)c1nnc(-c2cccc(N)n2)s1.
What is the InChIKey of 6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine?
The InChIKey is AAUSNBILLPDIKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3.C11H14N4.2C11H13N3O.C10H12N4O.4C10H12N4S/c1-9(2)10-5-6-12(16-8-10)11-4-3-7-15-13(11)14;1-8(2)9-6-15(7-13-9)11-5-3-4-10(12)14-11;1-7(2)8-3-4-9(13-6-8)10-5-11(12)15-14-10;1-7(2)11-13-6-9(15-11)8-4-3-5-10(12)14-8;1-6(2)8-4-3-7(5-12-8)9-13-10(11)14-15-9;1-6(2)7-3-13-8(4-12-7)10-14-9(11)5-15-10;1-6(2)9-12-3-7(4-13-9)10-14-8(11)5-15-10;1-6(2)7-5-13-10(15-7)9-12-4-3-8(11)14-9;1-6(2)9-13-14-10(15-9)7-4-3-5-8(11)12-7/h3-9H,1-2H3,(H2,14,15);3-8H,1-2H3,(H2,12,14);3-7H,12H2,1-2H3;3-7H,1-2H3,(H2,12,14);3-6H,1-2H3,(H2,11,14);2*3-6H,11H2,1-2H3;3-6H,1-2H3,(H2,11,12,14);3-6H,1-2H3,(H2,11,12).
What are the key properties of 6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine?
6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine has a molecular weight of 1907.47 g/mol, XLogP of 20.77, 18 rotatable bonds, 9 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-propan-2-ylimidazol-1-yl)pyridin-2-amine;6-(2-propan-2-yl-1,3-oxazol-5-yl)pyridin-2-amine;2-(5-propan-2-ylpyrazin-2-yl)-1,3-thiazol-4-amine;5-(6-propan-2-yl-3-pyridinyl)-1,2,4-oxadiazol-3-amine;3-(5-propan-2-yl-2-pyridinyl)-1,2-oxazol-5-amine;3-(5-propan-2-yl-2-pyridinyl)pyridin-2-amine;2-(2-propan-2-ylpyrimidin-5-yl)-1,3-thiazol-4-amine;6-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyridin-2-amine;2-(5-propan-2-yl-1,3-thiazol-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 157056431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).