8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane

C20H38N4 — CID 146389006

IUPAC8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane
SMILESCC(C)N1CC2(CCCN(CC(C)N3CC4(CCCCN4)C3)C2)C1
InChIInChI=1S/C20H38N4/c1-17(2)23-13-19(14-23)7-6-10-22(12-19)11-18(3)24-15-20(16-24)8-4-5-9-21-20/h17-18,21H,4-16H2,1-3H3
InChIKeyMOPDUYPFFZBHPK-UHFFFAOYSA-N
MW334.55 g/mol
LogP2.01
Rot. Bonds4

About 8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane

8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane (PubChem CID 146389006) has the molecular formula C20H38N4 and a molecular weight of 334.55 g/mol. Its IUPAC name is 8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane
PubChem CID146389006
Molecular FormulaC20H38N4
Molecular Weight334.55 g/mol
Exact Mass334.31
IUPAC Name8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane
SMILESCC(C)N1CC2(CCCN(CC(C)N3CC4(CCCCN4)C3)C2)C1
InChIInChI=1S/C20H38N4/c1-17(2)23-13-19(14-23)7-6-10-22(12-19)11-18(3)24-15-20(16-24)8-4-5-9-21-20/h17-18,21H,4-16H2,1-3H3
InChIKeyMOPDUYPFFZBHPK-UHFFFAOYSA-N
XLogP2.01
TPSA21.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.55
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane?
The IUPAC name of 8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane (CID 146389006) is 8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane.
What is the SMILES notation for 8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane?
The canonical SMILES for 8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane is CC(C)N1CC2(CCCN(CC(C)N3CC4(CCCCN4)C3)C2)C1.
What is the InChIKey of 8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane?
The InChIKey is MOPDUYPFFZBHPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38N4/c1-17(2)23-13-19(14-23)7-6-10-22(12-19)11-18(3)24-15-20(16-24)8-4-5-9-21-20/h17-18,21H,4-16H2,1-3H3.
What are the key properties of 8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane?
8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane has a molecular weight of 334.55 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-(2,5-diazaspiro[3.5]nonan-2-yl)propyl]-2-propan-2-yl-2,8-diazaspiro[3.5]nonane is sourced from PubChem (CID 146389006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).