10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane

C15H23N3 — CID 64871680

IUPAC10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane
SMILESc1cncc(CN2CCCNC3(CCCC3)C2)c1
InChIInChI=1S/C15H23N3/c1-2-7-15(6-1)13-18(10-4-9-17-15)12-14-5-3-8-16-11-14/h3,5,8,11,17H,1-2,4,6-7,9-10,12-13H2
InChIKeyNIHOZELMDUNILD-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.19
Rot. Bonds2

About 10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane

10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane (PubChem CID 64871680) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane.

Molecular Properties

Compound Name10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane
PubChem CID64871680
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane
SMILESc1cncc(CN2CCCNC3(CCCC3)C2)c1
InChIInChI=1S/C15H23N3/c1-2-7-15(6-1)13-18(10-4-9-17-15)12-14-5-3-8-16-11-14/h3,5,8,11,17H,1-2,4,6-7,9-10,12-13H2
InChIKeyNIHOZELMDUNILD-UHFFFAOYSA-N
XLogP2.19
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane?
The IUPAC name of 10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane (CID 64871680) is 10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane.
What is the SMILES notation for 10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane?
The canonical SMILES for 10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane is c1cncc(CN2CCCNC3(CCCC3)C2)c1.
What is the InChIKey of 10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane?
The InChIKey is NIHOZELMDUNILD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-2-7-15(6-1)13-18(10-4-9-17-15)12-14-5-3-8-16-11-14/h3,5,8,11,17H,1-2,4,6-7,9-10,12-13H2.
What are the key properties of 10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane?
10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane has a molecular weight of 245.37 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane is sourced from PubChem (CID 64871680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).