3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene)

C206H376N22OS2 — CID 159586937

About 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene)

3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene) (PubChem CID 159586937) has the molecular formula C206H376N22OS2 and a molecular weight of 3241.56 g/mol. Its IUPAC name is 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene).

Molecular Properties

• Compound Name: 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene)
• PubChem CID: 159586937
• Molecular Formula: C206H376N22OS2
• Molecular Weight: 3241.56 g/mol
• Exact Mass: 3238.95
• IUPAC Name: 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene)
• SMILES: CC(C)C1CCCN(C(C)C)C1.CC(C)C1CCCN(C(C)C)C1.CC(C)C1CCCN1C(C)C.CC(C)C1CCCN1C(C)C.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CCN(C(C)C)CC1.CC(C)N1CCN(C(C)C)CC1.CC(C)N1CCN(C(C)C)CC1.CC(C)c1c[nH]cc1C(C)C.CC(C)c1c[nH]cc1C(C)C.CC(C)c1cc(C(C)C)ncn1.CC(C)c1cc[nH]c1C(C)C.CC(C)c1cc[nH]c1C(C)C.CC(C)c1cccc(C(C)C)n1.CC(C)c1ccnc(C(C)C)c1.CC(C)c1cncc(C(C)C)c1.CC(C)c1cncc(C(C)C)n1.CC(C)c1conc1C(C)C.CC(C)c1cscc1C(C)C.CC(C)c1cscc1C(C)C
• InChI: InChI=1S/C11H17N.2C11H23N.C11H17N.2C11H23N.C11H17N.2C10H22N2.2C10H16N2.2C10H17N.2C10H21N.2C10H17N.2C10H16S.C9H15NO/c1-8(2)10-5-11(9(3)4)7-12-6-10;2*1-9(2)11-5-7-12(8-6-11)10(3)4;1-8(2)10-5-6-12-11(7-10)9(3)4;2*1-9(2)11-6-5-7-12(8-11)10(3)4;1-8(2)10-6-5-7-11(12-10)9(3)4;2*1-9(2)11-5-7-12(8-6-11)10(3)4;1-7(2)9-5-11-6-10(12-9)8(3)4;1-7(2)9-5-10(8(3)4)12-6-11-9;2*1-7(2)9-5-11-6-10(9)8(3)4;2*1-8(2)10-6-5-7-11(10)9(3)4;2*1-7(2)9-5-6-11-10(9)8(3)4;2*1-7(2)9-5-11-6-10(9)8(3)4;1-6(2)8-5-11-10-9(8)7(3)4/h5-9H,1-4H3;2*9-11H,5-8H2,1-4H3;5-9H,1-4H3;2*9-11H,5-8H2,1-4H3;5-9H,1-4H3;2*9-10H,5-8H2,1-4H3;2*5-8H,1-4H3;2*5-8,11H,1-4H3;2*8-10H,5-7H2,1-4H3;2*5-8,11H,1-4H3;2*5-8H,1-4H3;5-7H,1-4H3
• InChIKey: MJSUTHLHSMBGOP-UHFFFAOYSA-N
• XLogP: 58.31
• TPSA: 211.82 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 21
• Rotatable Bonds: 40
• Heavy Atoms: 231
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3241.56
LogP ≤ 5	58.31
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene)?

The IUPAC name of 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene) (CID 159586937) is 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene).

What is the SMILES notation for 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene)?

The canonical SMILES for 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene) is CC(C)C1CCCN(C(C)C)C1.CC(C)C1CCCN(C(C)C)C1.CC(C)C1CCCN1C(C)C.CC(C)C1CCCN1C(C)C.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CCN(C(C)C)CC1.CC(C)N1CCN(C(C)C)CC1.CC(C)N1CCN(C(C)C)CC1.CC(C)c1c[nH]cc1C(C)C.CC(C)c1c[nH]cc1C(C)C.CC(C)c1cc(C(C)C)ncn1.CC(C)c1cc[nH]c1C(C)C.CC(C)c1cc[nH]c1C(C)C.CC(C)c1cccc(C(C)C)n1.CC(C)c1ccnc(C(C)C)c1.CC(C)c1cncc(C(C)C)c1.CC(C)c1cncc(C(C)C)n1.CC(C)c1conc1C(C)C.CC(C)c1cscc1C(C)C.CC(C)c1cscc1C(C)C.

What is the InChIKey of 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene)?

The InChIKey is MJSUTHLHSMBGOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N.2C11H23N.C11H17N.2C11H23N.C11H17N.2C10H22N2.2C10H16N2.2C10H17N.2C10H21N.2C10H17N.2C10H16S.C9H15NO/c1-8(2)10-5-11(9(3)4)7-12-6-10;2*1-9(2)11-5-7-12(8-6-11)10(3)4;1-8(2)10-5-6-12-11(7-10)9(3)4;2*1-9(2)11-6-5-7-12(8-11)10(3)4;1-8(2)10-6-5-7-11(12-10)9(3)4;2*1-9(2)11-5-7-12(8-6-11)10(3)4;1-7(2)9-5-11-6-10(12-9)8(3)4;1-7(2)9-5-10(8(3)4)12-6-11-9;2*1-7(2)9-5-11-6-10(9)8(3)4;2*1-8(2)10-6-5-7-11(10)9(3)4;2*1-7(2)9-5-6-11-10(9)8(3)4;2*1-7(2)9-5-11-6-10(9)8(3)4;1-6(2)8-5-11-10-9(8)7(3)4/h5-9H,1-4H3;2*9-11H,5-8H2,1-4H3;5-9H,1-4H3;2*9-11H,5-8H2,1-4H3;5-9H,1-4H3;2*9-10H,5-8H2,1-4H3;2*5-8H,1-4H3;2*5-8,11H,1-4H3;2*8-10H,5-7H2,1-4H3;2*5-8,11H,1-4H3;2*5-8H,1-4H3;5-7H,1-4H3.

What are the key properties of 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene)?

3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene) has a molecular weight of 3241.56 g/mol, XLogP of 58.31, 40 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 3,4-di(propan-2-yl)-1,2-oxazole;bis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);2,6-di(propan-2-yl)pyrazine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;4,6-di(propan-2-yl)pyrimidine;bis(2,3-di(propan-2-yl)-1H-pyrrole);bis(3,4-di(propan-2-yl)-1H-pyrrole);bis(1,2-di(propan-2-yl)pyrrolidine);bis(3,4-di(propan-2-yl)thiophene) is sourced from PubChem (CID 159586937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).