9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane

C21H42N4 — CID 170708759

IUPAC9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane
SMILESCC(C)N1CCNC2(CCC2)C1.CC(C)N1CCNC2(CCCC2)C1
InChIInChI=1S/C11H22N2.C10H20N2/c1-10(2)13-8-7-12-11(9-13)5-3-4-6-11;1-9(2)12-7-6-11-10(8-12)4-3-5-10/h10,12H,3-9H2,1-2H3;9,11H,3-8H2,1-2H3
InChIKeyCAYKDYGZAGIIBY-UHFFFAOYSA-N
MW350.60 g/mol
LogP2.84
Rot. Bonds2

About 9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane

9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane (PubChem CID 170708759) has the molecular formula C21H42N4 and a molecular weight of 350.60 g/mol. Its IUPAC name is 9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane
PubChem CID170708759
Molecular FormulaC21H42N4
Molecular Weight350.60 g/mol
Exact Mass350.34
IUPAC Name9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane
SMILESCC(C)N1CCNC2(CCC2)C1.CC(C)N1CCNC2(CCCC2)C1
InChIInChI=1S/C11H22N2.C10H20N2/c1-10(2)13-8-7-12-11(9-13)5-3-4-6-11;1-9(2)12-7-6-11-10(8-12)4-3-5-10/h10,12H,3-9H2,1-2H3;9,11H,3-8H2,1-2H3
InChIKeyCAYKDYGZAGIIBY-UHFFFAOYSA-N
XLogP2.84
TPSA30.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.60
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane?
The IUPAC name of 9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane (CID 170708759) is 9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane.
What is the SMILES notation for 9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane?
The canonical SMILES for 9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane is CC(C)N1CCNC2(CCC2)C1.CC(C)N1CCNC2(CCCC2)C1.
What is the InChIKey of 9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane?
The InChIKey is CAYKDYGZAGIIBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2.C10H20N2/c1-10(2)13-8-7-12-11(9-13)5-3-4-6-11;1-9(2)12-7-6-11-10(8-12)4-3-5-10/h10,12H,3-9H2,1-2H3;9,11H,3-8H2,1-2H3.
What are the key properties of 9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane?
9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane has a molecular weight of 350.60 g/mol, XLogP of 2.84, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-propan-2-yl-6,9-diazaspiro[4.5]decane;8-propan-2-yl-5,8-diazaspiro[3.5]nonane is sourced from PubChem (CID 170708759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).