(5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane

C14H26N2 — CID 171359299

IUPAC(5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane
SMILESC1CCC(CCN2CC[C@@]3(CCCN3)C2)C1
InChIInChI=1S/C14H26N2/c1-2-5-13(4-1)6-10-16-11-8-14(12-16)7-3-9-15-14/h13,15H,1-12H2/t14-/m0/s1
InChIKeyOOSYJZQSDHVLFQ-AWEZNQCLSA-N
MW222.38 g/mol
LogP2.39
Rot. Bonds3

About (5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane

(5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane (PubChem CID 171359299) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is (5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane.

Molecular Properties

Compound Name(5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane
PubChem CID171359299
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name(5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane
SMILESC1CCC(CCN2CC[C@@]3(CCCN3)C2)C1
InChIInChI=1S/C14H26N2/c1-2-5-13(4-1)6-10-16-11-8-14(12-16)7-3-9-15-14/h13,15H,1-12H2/t14-/m0/s1
InChIKeyOOSYJZQSDHVLFQ-AWEZNQCLSA-N
XLogP2.39
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane?
The IUPAC name of (5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane (CID 171359299) is (5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane.
What is the SMILES notation for (5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane?
The canonical SMILES for (5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane is C1CCC(CCN2CC[C@@]3(CCCN3)C2)C1.
What is the InChIKey of (5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane?
The InChIKey is OOSYJZQSDHVLFQ-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H26N2/c1-2-5-13(4-1)6-10-16-11-8-14(12-16)7-3-9-15-14/h13,15H,1-12H2/t14-/m0/s1.
What are the key properties of (5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane?
(5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane has a molecular weight of 222.38 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-7-(2-cyclopentylethyl)-1,7-diazaspiro[4.4]nonane is sourced from PubChem (CID 171359299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).