8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane

C20H38N4 — CID 129237357

IUPAC8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane
SMILESCC(C)N1CC(CC(C)N2CCCC3(CCN3)C2)CC2(CNC2)C1
InChIInChI=1S/C20H38N4/c1-16(2)24-11-18(10-19(14-24)12-21-13-19)9-17(3)23-8-4-5-20(15-23)6-7-22-20/h16-18,21-22H,4-15H2,1-3H3
InChIKeyADVCYLRBESSCEF-UHFFFAOYSA-N
MW334.55 g/mol
LogP1.91
Rot. Bonds4

About 8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane

8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane (PubChem CID 129237357) has the molecular formula C20H38N4 and a molecular weight of 334.55 g/mol. Its IUPAC name is 8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane
PubChem CID129237357
Molecular FormulaC20H38N4
Molecular Weight334.55 g/mol
Exact Mass334.31
IUPAC Name8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane
SMILESCC(C)N1CC(CC(C)N2CCCC3(CCN3)C2)CC2(CNC2)C1
InChIInChI=1S/C20H38N4/c1-16(2)24-11-18(10-19(14-24)12-21-13-19)9-17(3)23-8-4-5-20(15-23)6-7-22-20/h16-18,21-22H,4-15H2,1-3H3
InChIKeyADVCYLRBESSCEF-UHFFFAOYSA-N
XLogP1.91
TPSA30.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.55
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane?
The IUPAC name of 8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane (CID 129237357) is 8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane.
What is the SMILES notation for 8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane?
The canonical SMILES for 8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane is CC(C)N1CC(CC(C)N2CCCC3(CCN3)C2)CC2(CNC2)C1.
What is the InChIKey of 8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane?
The InChIKey is ADVCYLRBESSCEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38N4/c1-16(2)24-11-18(10-19(14-24)12-21-13-19)9-17(3)23-8-4-5-20(15-23)6-7-22-20/h16-18,21-22H,4-15H2,1-3H3.
What are the key properties of 8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane?
8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane has a molecular weight of 334.55 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-(1,8-diazaspiro[3.5]nonan-8-yl)propyl]-6-propan-2-yl-2,6-diazaspiro[3.5]nonane is sourced from PubChem (CID 129237357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).