4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane

C12H24N2 — CID 121459196

IUPAC4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane
SMILESCCCN1CCN(C(C)C)C2(CC2)C1
InChIInChI=1S/C12H24N2/c1-4-7-13-8-9-14(11(2)3)12(10-13)5-6-12/h11H,4-10H2,1-3H3
InChIKeyZEDFRDNJQWUORN-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.96
Rot. Bonds3

About 4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane

4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane (PubChem CID 121459196) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane.

Molecular Properties

Compound Name4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane
PubChem CID121459196
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane
SMILESCCCN1CCN(C(C)C)C2(CC2)C1
InChIInChI=1S/C12H24N2/c1-4-7-13-8-9-14(11(2)3)12(10-13)5-6-12/h11H,4-10H2,1-3H3
InChIKeyZEDFRDNJQWUORN-UHFFFAOYSA-N
XLogP1.96
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-propan-2-yl-7-(3,3,3-trifluoropropyl)-4,7-diazaspiro[2.5]octane
CID 129212928
4-tert-butyl-7-propyl-4,7-diazaspiro[2.5]octane
CID 174296005
ethane;4-propan-2-yl-4-azaspiro[2.4]heptane
CID 170635118
(3R)-3-fluoro-3-methyl-1-propylpyrrolidine
CID 177367853
7-propan-2-yl-3-propyl-1-oxa-3,7-diazaspiro[4.4]nonane
CID 176693517
3-fluoro-3-propan-2-yl-1-propylazetidine
CID 163258527
ethane;7-propyl-2-oxa-7-azaspiro[4.4]nonane
CID 171515874
4,4-dimethyl-1-(2-methylpropyl)piperidine;3,3-dimethyl-1-propylpiperidine
CID 177033063
7-propyl-1-oxa-7-azaspiro[3.5]nonane
CID 131102344
2-propan-2-yl-7-[(1-propylazetidin-3-yl)methyl]-2,7-diazaspiro[3.5]nonane
CID 155599548
1-propyl-4-(2-pyrrolidin-1-ylethyl)piperazine
CID 135208810
3-(hydroxymethyl)-1-propylpiperidin-3-ol
CID 130689857

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane?
The IUPAC name of 4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane (CID 121459196) is 4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane.
What is the SMILES notation for 4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane?
The canonical SMILES for 4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane is CCCN1CCN(C(C)C)C2(CC2)C1.
What is the InChIKey of 4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane?
The InChIKey is ZEDFRDNJQWUORN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-4-7-13-8-9-14(11(2)3)12(10-13)5-6-12/h11H,4-10H2,1-3H3.
What are the key properties of 4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane?
4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane has a molecular weight of 196.34 g/mol, XLogP of 1.96, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-7-propyl-4,7-diazaspiro[2.5]octane is sourced from PubChem (CID 121459196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).