9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane

C14H21N3 — CID 175764733

IUPAC9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane
SMILESc1ccc(N2CCC3(CCCNC3)CC2)nc1
InChIInChI=1S/C14H21N3/c1-2-9-16-13(4-1)17-10-6-14(7-11-17)5-3-8-15-12-14/h1-2,4,9,15H,3,5-8,10-12H2
InChIKeyHTBWXYOIKGDBQZ-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.05
Rot. Bonds1

About 9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane

9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane (PubChem CID 175764733) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is 9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane
PubChem CID175764733
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC Name9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane
SMILESc1ccc(N2CCC3(CCCNC3)CC2)nc1
InChIInChI=1S/C14H21N3/c1-2-9-16-13(4-1)17-10-6-14(7-11-17)5-3-8-15-12-14/h1-2,4,9,15H,3,5-8,10-12H2
InChIKeyHTBWXYOIKGDBQZ-UHFFFAOYSA-N
XLogP2.05
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5S)-2-pyrazin-2-yl-2,9-diazaspiro[4.5]decane
CID 95203740
2-[(5R)-2,9-diazaspiro[4.5]decan-2-yl]pyridine-3-carboxylic acid
CID 95228465
2-pyrimidin-4-yl-2,8-diazaspiro[5.5]undecane
CID 102850610
(5S)-2-(4-methylpyrimidin-2-yl)-2,9-diazaspiro[4.5]decane
CID 95222078
9-(7H-purin-6-yl)-2,9-diazaspiro[5.5]undecane
CID 70789255
(5S)-7-methylsulfonyl-2-pyridin-2-yl-2,7-diazaspiro[4.5]decane
CID 3234926
1-(2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl)ethanone
CID 134074831
3-(4-pyridin-2-ylpiperazin-1-yl)azepane
CID 62642071
4-amino-1-pyridin-2-ylpiperidine-4-carbonitrile
CID 170991125
2,2-dimethyl-1-pyridin-2-ylpiperazine
CID 55248494
7-pyridin-2-yl-2-oxa-7-azaspiro[4.4]nonane
CID 71921202
[1-(4-pyridin-2-ylpiperazin-1-yl)cyclopentyl]methanamine
CID 24698765

Frequently Asked Questions

What is the IUPAC name of 9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane?
The IUPAC name of 9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane (CID 175764733) is 9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane.
What is the SMILES notation for 9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane?
The canonical SMILES for 9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane is c1ccc(N2CCC3(CCCNC3)CC2)nc1.
What is the InChIKey of 9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane?
The InChIKey is HTBWXYOIKGDBQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c1-2-9-16-13(4-1)17-10-6-14(7-11-17)5-3-8-15-12-14/h1-2,4,9,15H,3,5-8,10-12H2.
What are the key properties of 9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane?
9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane has a molecular weight of 231.34 g/mol, XLogP of 2.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-pyridin-2-yl-2,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 175764733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).