7-octan-4-yl-1,7-diazaspiro[3.5]nonane

C15H30N2 — CID 134177848

IUPAC7-octan-4-yl-1,7-diazaspiro[3.5]nonane
SMILESCCCCC(CCC)N1CCC2(CCN2)CC1
InChIInChI=1S/C15H30N2/c1-3-5-7-14(6-4-2)17-12-9-15(10-13-17)8-11-16-15/h14,16H,3-13H2,1-2H3
InChIKeyJCOZMXLZXAQSPL-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.17
Rot. Bonds6

About 7-octan-4-yl-1,7-diazaspiro[3.5]nonane

7-octan-4-yl-1,7-diazaspiro[3.5]nonane (PubChem CID 134177848) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 7-octan-4-yl-1,7-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name7-octan-4-yl-1,7-diazaspiro[3.5]nonane
PubChem CID134177848
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name7-octan-4-yl-1,7-diazaspiro[3.5]nonane
SMILESCCCCC(CCC)N1CCC2(CCN2)CC1
InChIInChI=1S/C15H30N2/c1-3-5-7-14(6-4-2)17-12-9-15(10-13-17)8-11-16-15/h14,16H,3-13H2,1-2H3
InChIKeyJCOZMXLZXAQSPL-UHFFFAOYSA-N
XLogP3.17
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-octan-4-yl-1,7-diazaspiro[3.5]nonane?
The IUPAC name of 7-octan-4-yl-1,7-diazaspiro[3.5]nonane (CID 134177848) is 7-octan-4-yl-1,7-diazaspiro[3.5]nonane.
What is the SMILES notation for 7-octan-4-yl-1,7-diazaspiro[3.5]nonane?
The canonical SMILES for 7-octan-4-yl-1,7-diazaspiro[3.5]nonane is CCCCC(CCC)N1CCC2(CCN2)CC1.
What is the InChIKey of 7-octan-4-yl-1,7-diazaspiro[3.5]nonane?
The InChIKey is JCOZMXLZXAQSPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-3-5-7-14(6-4-2)17-12-9-15(10-13-17)8-11-16-15/h14,16H,3-13H2,1-2H3.
What are the key properties of 7-octan-4-yl-1,7-diazaspiro[3.5]nonane?
7-octan-4-yl-1,7-diazaspiro[3.5]nonane has a molecular weight of 238.42 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-octan-4-yl-1,7-diazaspiro[3.5]nonane is sourced from PubChem (CID 134177848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).