7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane

C95H188N20O3 — CID 158943456

About 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane

7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane (PubChem CID 158943456) has the molecular formula C95H188N20O3 and a molecular weight of 1658.69 g/mol. Its IUPAC name is 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane.

Molecular Properties

• Compound Name: 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane
• PubChem CID: 158943456
• Molecular Formula: C95H188N20O3
• Molecular Weight: 1658.69 g/mol
• Exact Mass: 1657.52
• IUPAC Name: 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane
• SMILES: C.C1CC2(CCN1)CCNC2.C1CC2(CCN1)CCNCC2.C1CC2(CCN1)CNC2.C1CC2(CCN1)CNCCO2.C1CC2(CCNC2)CN1.C1CCC2(C1)CCCNC2.C1CCC2(CC2)NC1.C1CNCC2(C1)CCC2.C1CNCC2(C1)CCC2.C1CNCC2(C1)CCNC2.C1CNCC2(C1)CNCCO2.C1COC2(CCNC2)CN1
• InChI: InChI=1S/C9H18N2.C9H17N.2C8H16N2O.2C8H16N2.2C8H15N.C7H14N2O.2C7H14N2.C7H13N.CH4/c1-5-10-6-2-9(1)3-7-11-8-4-9;1-2-5-9(4-1)6-3-7-10-8-9;1-3-9-4-2-8(1)7-10-5-6-11-8;1-2-8(6-9-3-1)7-10-4-5-11-8;1-4-9-5-2-8(1)3-6-10-7-8;1-2-8(6-9-4-1)3-5-10-7-8;2*1-3-8(4-1)5-2-6-9-7-8;1-2-8-5-7(1)6-9-3-4-10-7;1-3-8-5-7(1)2-4-9-6-7;1-3-8-4-2-7(1)5-9-6-7;1-2-6-8-7(3-1)4-5-7;/h10-11H,1-8H2;10H,1-8H2;2*9-10H,1-7H2;2*9-10H,1-7H2;2*9H,1-7H2;8-9H,1-6H2;2*8-9H,1-6H2;8H,1-6H2;1H4
• InChIKey: JKNPHRFBPCEMTL-UHFFFAOYSA-N
• XLogP: 7.09
• TPSA: 268.29 Ų
• H-Bond Donors: 20
• H-Bond Acceptors: 23
• Heavy Atoms: 118
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1658.69
LogP ≤ 5	7.09
H-Bond Donors ≤ 5	20
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane?

The IUPAC name of 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane (CID 158943456) is 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane.

What is the SMILES notation for 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane?

The canonical SMILES for 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane is C.C1CC2(CCN1)CCNC2.C1CC2(CCN1)CCNCC2.C1CC2(CCN1)CNC2.C1CC2(CCN1)CNCCO2.C1CC2(CCNC2)CN1.C1CCC2(C1)CCCNC2.C1CCC2(CC2)NC1.C1CNCC2(C1)CCC2.C1CNCC2(C1)CCC2.C1CNCC2(C1)CCNC2.C1CNCC2(C1)CNCCO2.C1COC2(CCNC2)CN1.

What is the InChIKey of 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane?

The InChIKey is JKNPHRFBPCEMTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2.C9H17N.2C8H16N2O.2C8H16N2.2C8H15N.C7H14N2O.2C7H14N2.C7H13N.CH4/c1-5-10-6-2-9(1)3-7-11-8-4-9;1-2-5-9(4-1)6-3-7-10-8-9;1-3-9-4-2-8(1)7-10-5-6-11-8;1-2-8(6-9-3-1)7-10-4-5-11-8;1-4-9-5-2-8(1)3-6-10-7-8;1-2-8(6-9-4-1)3-5-10-7-8;2*1-3-8(4-1)5-2-6-9-7-8;1-2-8-5-7(1)6-9-3-4-10-7;1-3-8-5-7(1)2-4-9-6-7;1-3-8-4-2-7(1)5-9-6-7;1-2-6-8-7(3-1)4-5-7;/h10-11H,1-8H2;10H,1-8H2;2*9-10H,1-7H2;2*9-10H,1-7H2;2*9H,1-7H2;8-9H,1-6H2;2*8-9H,1-6H2;8H,1-6H2;1H4.

What are the key properties of 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane?

7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane has a molecular weight of 1658.69 g/mol, XLogP of 7.09, 0 rotatable bonds, 20 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 7-azaspiro[4.5]decane;bis(6-azaspiro[3.5]nonane);4-azaspiro[2.5]octane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;3,9-diazaspiro[5.5]undecane;methane;6-oxa-2,9-diazaspiro[4.5]decane;1-oxa-4,8-diazaspiro[5.5]undecane;1-oxa-4,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 158943456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).