2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane

C14H21N3 — CID 120908225

IUPAC2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane
SMILESCc1ccc(CN2CCC3(CCNC3)C2)nc1
InChIInChI=1S/C14H21N3/c1-12-2-3-13(16-8-12)9-17-7-5-14(11-17)4-6-15-10-14/h2-3,8,15H,4-7,9-11H2,1H3
InChIKeyARTUXYJVRKYLDA-UHFFFAOYSA-N
MW231.34 g/mol
LogP1.58
Rot. Bonds2

About 2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane

2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane (PubChem CID 120908225) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is 2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane.

Molecular Properties

Compound Name2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane
PubChem CID120908225
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC Name2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane
SMILESCc1ccc(CN2CCC3(CCNC3)C2)nc1
InChIInChI=1S/C14H21N3/c1-12-2-3-13(16-8-12)9-17-7-5-14(11-17)4-6-15-10-14/h2-3,8,15H,4-7,9-11H2,1H3
InChIKeyARTUXYJVRKYLDA-UHFFFAOYSA-N
XLogP1.58
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2,7-diazaspiro[4.4]nonan-2-ylmethyl)-7-methylimidazo[1,2-a]pyridine
CID 120908377
2-[(2,4-dimethylphenyl)methyl]-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120907707
2-[(2-bromo-4-methylphenyl)methyl]-2,7-diazaspiro[4.4]nonane
CID 120908668
4-(2,7-diazaspiro[4.4]nonan-2-ylmethyl)-2-[(4-methylphenoxy)methyl]-1,3-thiazole;hydrochloride
CID 120907679
2-[(1-methyltriazol-4-yl)methyl]-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120907965
5-(2,7-diazaspiro[4.4]nonan-2-ylmethyl)-N-ethyl-N-methylpyridin-2-amine;hydrochloride
CID 120908695
2-[(1-methylpyrazol-4-yl)methyl]-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120907742
(5R)-2-benzyl-2,7-diazaspiro[4.4]nonane
CID 34178522
2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine
CID 142253116
2-[(1-ethylpyrazol-4-yl)methyl]-2,7-diazaspiro[4.4]nonane
CID 120907844
2-(1H-pyrazol-5-ylmethyl)-2,7-diazaspiro[4.4]nonane
CID 120908157
2-[(2-methylpyrazol-3-yl)methyl]-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120908563

Frequently Asked Questions

What is the IUPAC name of 2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane?
The IUPAC name of 2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane (CID 120908225) is 2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane.
What is the SMILES notation for 2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane?
The canonical SMILES for 2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane is Cc1ccc(CN2CCC3(CCNC3)C2)nc1.
What is the InChIKey of 2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane?
The InChIKey is ARTUXYJVRKYLDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c1-12-2-3-13(16-8-12)9-17-7-5-14(11-17)4-6-15-10-14/h2-3,8,15H,4-7,9-11H2,1H3.
What are the key properties of 2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane?
2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane has a molecular weight of 231.34 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.4]nonane is sourced from PubChem (CID 120908225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).