4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide

C144H188N18O9S4 — CID 160559732

IUPAC4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide
SMILESCC(C)C(OCc1ccccc1)c1cccs1.CC(C)c1c[nH]c2ccccc12.CC(C)c1cc2ccccc2cn1.CC(C)c1cc2ccccc2s1.CC(C)c1ccco1.CC(C)c1cnccn1.CC(C)c1nccnc1N.CC(C)c1nccs1.CC(C)c1ncoc1NC(=O)c1ccc(C(C)(C)C)cc1.CC(C)c1ncoc1NC(=O)c1ccccc1.CC(C)c1ncsc1NC(=O)c1ccccc1.CCCC(O)C(C)C.Cc1cc(C(C)C)no1.Cc1cc(C)n2ncc(C(C)C)c2n1
InChIInChI=1S/C17H22N2O2.C15H18OS.C13H14N2O2.C13H14N2OS.C12H13N.C11H15N3.C11H13N.C11H12S.C7H11N3.C7H10N2.C7H11NO.C7H10O.C7H16O.C6H9NS/c1-11(2)14-16(21-10-18-14)19-15(20)12-6-8-13(9-7-12)17(3,4)5;1-12(2)15(14-9-6-10-17-14)16-11-13-7-4-3-5-8-13;2*1-9(2)11-13(17-8-14-11)15-12(16)10-6-4-3-5-7-10;1-9(2)12-7-10-5-3-4-6-11(10)8-13-12;1-7(2)10-6-12-14-9(4)5-8(3)13-11(10)14;1-8(2)10-7-12-11-6-4-3-5-9(10)11;1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-5(2)6-7(8)10-4-3-9-6;1-6(2)7-5-8-3-4-9-7;1-5(2)7-4-6(3)9-8-7;1-6(2)7-4-3-5-8-7;1-4-5-7(8)6(2)3;1-5(2)6-7-3-4-8-6/h6-11H,1-5H3,(H,19,20);3-10,12,15H,11H2,1-2H3;2*3-9H,1-2H3,(H,15,16);3-9H,1-2H3;5-7H,1-4H3;3-8,12H,1-2H3;3-8H,1-2H3;3-5H,1-2H3,(H2,8,10);3-6H,1-2H3;4-5H,1-3H3;3-6H,1-2H3;6-8H,4-5H2,1-3H3;3-5H,1-2H3
InChIKeyQZDLIAHRALNSIQ-UHFFFAOYSA-N
MW2443.47 g/mol
LogP40.08
Rot. Bonds26

About 4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide

4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide (PubChem CID 160559732) has the molecular formula C144H188N18O9S4 and a molecular weight of 2443.47 g/mol. Its IUPAC name is 4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide.

Molecular Properties

Compound Name4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide
PubChem CID160559732
Molecular FormulaC144H188N18O9S4
Molecular Weight2443.47 g/mol
Exact Mass2441.37
IUPAC Name4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide
SMILESCC(C)C(OCc1ccccc1)c1cccs1.CC(C)c1c[nH]c2ccccc12.CC(C)c1cc2ccccc2cn1.CC(C)c1cc2ccccc2s1.CC(C)c1ccco1.CC(C)c1cnccn1.CC(C)c1nccnc1N.CC(C)c1nccs1.CC(C)c1ncoc1NC(=O)c1ccc(C(C)(C)C)cc1.CC(C)c1ncoc1NC(=O)c1ccccc1.CC(C)c1ncsc1NC(=O)c1ccccc1.CCCC(O)C(C)C.Cc1cc(C(C)C)no1.Cc1cc(C)n2ncc(C(C)C)c2n1
InChIInChI=1S/C17H22N2O2.C15H18OS.C13H14N2O2.C13H14N2OS.C12H13N.C11H15N3.C11H13N.C11H12S.C7H11N3.C7H10N2.C7H11NO.C7H10O.C7H16O.C6H9NS/c1-11(2)14-16(21-10-18-14)19-15(20)12-6-8-13(9-7-12)17(3,4)5;1-12(2)15(14-9-6-10-17-14)16-11-13-7-4-3-5-8-13;2*1-9(2)11-13(17-8-14-11)15-12(16)10-6-4-3-5-7-10;1-9(2)12-7-10-5-3-4-6-11(10)8-13-12;1-7(2)10-6-12-14-9(4)5-8(3)13-11(10)14;1-8(2)10-7-12-11-6-4-3-5-9(10)11;1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-5(2)6-7(8)10-4-3-9-6;1-6(2)7-5-8-3-4-9-7;1-5(2)7-4-6(3)9-8-7;1-6(2)7-4-3-5-8-7;1-4-5-7(8)6(2)3;1-5(2)6-7-3-4-8-6/h6-11H,1-5H3,(H,19,20);3-10,12,15H,11H2,1-2H3;2*3-9H,1-2H3,(H,15,16);3-9H,1-2H3;5-7H,1-4H3;3-8,12H,1-2H3;3-8H,1-2H3;3-5H,1-2H3,(H2,8,10);3-6H,1-2H3;4-5H,1-3H3;3-6H,1-2H3;6-8H,4-5H2,1-3H3;3-5H,1-2H3
InChIKeyQZDLIAHRALNSIQ-UHFFFAOYSA-N
XLogP40.08
TPSA370.22 Ų
H-Bond Donors6
H-Bond Acceptors27
Rotatable Bonds26
Heavy Atoms175
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002443.47
LogP ≤ 540.08
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1027

Analyze 4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide with MolForge

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Launch Full Analysis

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide?
The IUPAC name of 4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide (CID 160559732) is 4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide.
What is the SMILES notation for 4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide?
The canonical SMILES for 4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide is CC(C)C(OCc1ccccc1)c1cccs1.CC(C)c1c[nH]c2ccccc12.CC(C)c1cc2ccccc2cn1.CC(C)c1cc2ccccc2s1.CC(C)c1ccco1.CC(C)c1cnccn1.CC(C)c1nccnc1N.CC(C)c1nccs1.CC(C)c1ncoc1NC(=O)c1ccc(C(C)(C)C)cc1.CC(C)c1ncoc1NC(=O)c1ccccc1.CC(C)c1ncsc1NC(=O)c1ccccc1.CCCC(O)C(C)C.Cc1cc(C(C)C)no1.Cc1cc(C)n2ncc(C(C)C)c2n1.
What is the InChIKey of 4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide?
The InChIKey is QZDLIAHRALNSIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2.C15H18OS.C13H14N2O2.C13H14N2OS.C12H13N.C11H15N3.C11H13N.C11H12S.C7H11N3.C7H10N2.C7H11NO.C7H10O.C7H16O.C6H9NS/c1-11(2)14-16(21-10-18-14)19-15(20)12-6-8-13(9-7-12)17(3,4)5;1-12(2)15(14-9-6-10-17-14)16-11-13-7-4-3-5-8-13;2*1-9(2)11-13(17-8-14-11)15-12(16)10-6-4-3-5-7-10;1-9(2)12-7-10-5-3-4-6-11(10)8-13-12;1-7(2)10-6-12-14-9(4)5-8(3)13-11(10)14;1-8(2)10-7-12-11-6-4-3-5-9(10)11;1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-5(2)6-7(8)10-4-3-9-6;1-6(2)7-5-8-3-4-9-7;1-5(2)7-4-6(3)9-8-7;1-6(2)7-4-3-5-8-7;1-4-5-7(8)6(2)3;1-5(2)6-7-3-4-8-6/h6-11H,1-5H3,(H,19,20);3-10,12,15H,11H2,1-2H3;2*3-9H,1-2H3,(H,15,16);3-9H,1-2H3;5-7H,1-4H3;3-8,12H,1-2H3;3-8H,1-2H3;3-5H,1-2H3,(H2,8,10);3-6H,1-2H3;4-5H,1-3H3;3-6H,1-2H3;6-8H,4-5H2,1-3H3;3-5H,1-2H3.
What are the key properties of 4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide?
4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide has a molecular weight of 2443.47 g/mol, XLogP of 40.08, 26 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;5,7-dimethyl-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-methylhexan-3-ol;2-(2-methyl-1-phenylmethoxypropyl)thiophene;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-yl-1-benzothiophene;2-propan-2-ylfuran;3-propan-2-yl-1H-indole;3-propan-2-ylisoquinoline;N-(4-propan-2-yl-1,3-oxazol-5-yl)benzamide;3-propan-2-ylpyrazin-2-amine;2-propan-2-ylpyrazine;2-propan-2-yl-1,3-thiazole;N-(4-propan-2-yl-1,3-thiazol-5-yl)benzamide is sourced from PubChem (CID 160559732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).