bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)

C222H502N22 — CID 165075427

About bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)

bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine) (PubChem CID 165075427) has the molecular formula C222H502N22 and a molecular weight of 3480.61 g/mol. Its IUPAC name is bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine).

Molecular Properties

• Compound Name: bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)
• PubChem CID: 165075427
• Molecular Formula: C222H502N22
• Molecular Weight: 3480.61 g/mol
• Exact Mass: 3478.00
• IUPAC Name: bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)
• SMILES: CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)C1CCCCN1C(C)C.CC(C)C1CCCCN1C(C)C.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)C1.CC(C)C1CCN(C(C)C)C1.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CCN1C(C)C.CC(C)C1CCN1C(C)C.CC(C)C1CN(C(C)C)C1.CC(C)C1CN(C(C)C)C1.CC(C)C1CN(C(C)C)CCN1C.CC(C)C1CN(C(C)C)CCN1C.CC(C)C1CN(C)CCN1C(C)C.CC(C)C1CN(C)CCN1C(C)C
• InChI: InChI=1S/4C11H24N2.6C11H23N.4C10H21N.4C9H19N.18C2H6/c2*1-9(2)11-8-13(10(3)4)7-6-12(11)5;2*1-9(2)11-8-12(5)6-7-13(11)10(3)4;2*1-9(2)11-5-7-12(8-6-11)10(3)4;2*1-9(2)11-6-5-7-12(8-11)10(3)4;2*1-9(2)11-7-5-6-8-12(11)10(3)4;2*1-8(2)10-5-6-11(7-10)9(3)4;2*1-8(2)10-6-5-7-11(10)9(3)4;2*1-7(2)9-5-10(6-9)8(3)4;2*1-7(2)9-5-6-10(9)8(3)4;18*1-2/h4*9-11H,6-8H2,1-5H3;6*9-11H,5-8H2,1-4H3;4*8-10H,5-7H2,1-4H3;4*7-9H,5-6H2,1-4H3;18*1-2H3
• InChIKey: UFQANFCCKQVBSC-UHFFFAOYSA-N
• XLogP: 59.99
• TPSA: 71.28 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 36
• Heavy Atoms: 244
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3480.61
LogP ≤ 5	59.99
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)?

The IUPAC name of bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine) (CID 165075427) is bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine).

What is the SMILES notation for bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)?

The canonical SMILES for bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine) is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)C1CCCCN1C(C)C.CC(C)C1CCCCN1C(C)C.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)C1.CC(C)C1CCN(C(C)C)C1.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CCN1C(C)C.CC(C)C1CCN1C(C)C.CC(C)C1CN(C(C)C)C1.CC(C)C1CN(C(C)C)C1.CC(C)C1CN(C(C)C)CCN1C.CC(C)C1CN(C(C)C)CCN1C.CC(C)C1CN(C)CCN1C(C)C.CC(C)C1CN(C)CCN1C(C)C.

What is the InChIKey of bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)?

The InChIKey is UFQANFCCKQVBSC-UHFFFAOYSA-N. The full InChI is InChI=1S/4C11H24N2.6C11H23N.4C10H21N.4C9H19N.18C2H6/c2*1-9(2)11-8-13(10(3)4)7-6-12(11)5;2*1-9(2)11-8-12(5)6-7-13(11)10(3)4;2*1-9(2)11-5-7-12(8-6-11)10(3)4;2*1-9(2)11-6-5-7-12(8-11)10(3)4;2*1-9(2)11-7-5-6-8-12(11)10(3)4;2*1-8(2)10-5-6-11(7-10)9(3)4;2*1-8(2)10-6-5-7-11(10)9(3)4;2*1-7(2)9-5-10(6-9)8(3)4;2*1-7(2)9-5-6-10(9)8(3)4;18*1-2/h4*9-11H,6-8H2,1-5H3;6*9-11H,5-8H2,1-4H3;4*8-10H,5-7H2,1-4H3;4*7-9H,5-6H2,1-4H3;18*1-2H3.

What are the key properties of bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)?

bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine) has a molecular weight of 3480.61 g/mol, XLogP of 59.99, 36 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine) is sourced from PubChem (CID 165075427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).