4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane — IUPAC name, SMILES, InChIKey & properties

Name: 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

About 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane

4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane (PubChem CID 161325935) has the molecular formula C90H179N23 and a molecular weight of 1583.58 g/mol. Its IUPAC name is 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name	4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane
PubChem CID	161325935
Molecular Formula	C90H179N23
Molecular Weight	1583.58 g/mol
Exact Mass	1582.47
IUPAC Name	4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane
SMILES	C1CC2(CCN1)CCNC2.C1CC2(CCN1)CCNCC2.C1CC2(CCN1)CNC2.C1CC2(CCNC2)CN1.C1CC2(CN1)CNC2.C1CCC2(CCNC2)NC1.C1CCC2(CCNCC2)NC1.C1CNC2(C1)CC2.C1CNC2(C1)CCNC2.C1CNC2(CC2)CN1.C1CNCC2(C1)CCNC2.C1CNCC2(C1)CCNCC2
InChI	InChI=1S/3C9H18N2.3C8H16N2.3C7H14N2.2C6H12N2.C6H11N/c1-5-10-6-2-9(1)3-7-11-8-4-9;1-2-9(8-11-5-1)3-6-10-7-4-9;1-2-6-11-9(3-1)4-7-10-8-5-9;1-4-9-5-2-8(1)3-6-10-7-8;1-2-8(6-9-4-1)3-5-10-7-8;1-2-5-10-8(3-1)4-6-9-7-8;1-3-8-5-7(1)2-4-9-6-7;1-3-8-4-2-7(1)5-9-6-7;1-2-7(9-4-1)3-5-8-6-7;1-2-7-3-6(1)4-8-5-6;1-2-6(1)5-7-3-4-8-6;1-2-6(3-4-6)7-5-1/h310-11H,1-8H2;39-10H,1-7H2;38-9H,1-6H2;27-8H,1-5H2;7H,1-5H2
InChIKey	VKTPTHQSKIZBOX-UHFFFAOYSA-N
XLogP	3.76
TPSA	276.69 Å²
H-Bond Donors	23
H-Bond Acceptors	23
Rotatable Bonds
Heavy Atoms	113
Complexity	—

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1583.58
LogP ≤ 5	3.76
H-Bond Donors ≤ 5	23
H-Bond Acceptors ≤ 10	23

Analyze 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane?

The IUPAC name of 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane (CID 161325935) is 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane.

What is the SMILES notation for 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane?

The canonical SMILES for 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane is C1CC2(CCN1)CCNC2.C1CC2(CCN1)CCNCC2.C1CC2(CCN1)CNC2.C1CC2(CCNC2)CN1.C1CC2(CN1)CNC2.C1CCC2(CCNC2)NC1.C1CCC2(CCNCC2)NC1.C1CNC2(C1)CC2.C1CNC2(C1)CCNC2.C1CNC2(CC2)CN1.C1CNCC2(C1)CCNC2.C1CNCC2(C1)CCNCC2.

What is the InChIKey of 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane?

The InChIKey is VKTPTHQSKIZBOX-UHFFFAOYSA-N. The full InChI is InChI=1S/3C9H18N2.3C8H16N2.3C7H14N2.2C6H12N2.C6H11N/c1-5-10-6-2-9(1)3-7-11-8-4-9;1-2-9(8-11-5-1)3-6-10-7-4-9;1-2-6-11-9(3-1)4-7-10-8-5-9;1-4-9-5-2-8(1)3-6-10-7-8;1-2-8(6-9-4-1)3-5-10-7-8;1-2-5-10-8(3-1)4-6-9-7-8;1-3-8-5-7(1)2-4-9-6-7;1-3-8-4-2-7(1)5-9-6-7;1-2-7(9-4-1)3-5-8-6-7;1-2-7-3-6(1)4-8-5-6;1-2-6(1)5-7-3-4-8-6;1-2-6(3-4-6)7-5-1/h3*10-11H,1-8H2;3*9-10H,1-7H2;3*8-9H,1-6H2;2*7-8H,1-5H2;7H,1-5H2.

What are the key properties of 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane?

Where does this data come from?

All data for 4-azaspiro[2.4]heptane;2,6-diazaspiro[4.5]decane;2,8-diazaspiro[4.5]decane;2,9-diazaspiro[4.5]decane;1,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.5]nonane;2,7-diazaspiro[4.4]nonane;2,7-diazaspiro[3.4]octane;4,7-diazaspiro[2.5]octane;1,9-diazaspiro[5.5]undecane;2,9-diazaspiro[5.5]undecane;3,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 161325935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).