2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane

C15H22FN3 — CID 154761920

IUPAC2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane
SMILESCC1CC2(CCNCC2)CN1Cc1cncc(F)c1
InChIInChI=1S/C15H22FN3/c1-12-7-15(2-4-17-5-3-15)11-19(12)10-13-6-14(16)9-18-8-13/h6,8-9,12,17H,2-5,7,10-11H2,1H3
InChIKeyJEVOKBXUSWRUMJ-UHFFFAOYSA-N
MW263.36 g/mol
LogP2.18
Rot. Bonds2

About 2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane

2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane (PubChem CID 154761920) has the molecular formula C15H22FN3 and a molecular weight of 263.36 g/mol. Its IUPAC name is 2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane
PubChem CID154761920
Molecular FormulaC15H22FN3
Molecular Weight263.36 g/mol
Exact Mass263.18
IUPAC Name2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane
SMILESCC1CC2(CCNCC2)CN1Cc1cncc(F)c1
InChIInChI=1S/C15H22FN3/c1-12-7-15(2-4-17-5-3-15)11-19(12)10-13-6-14(16)9-18-8-13/h6,8-9,12,17H,2-5,7,10-11H2,1H3
InChIKeyJEVOKBXUSWRUMJ-UHFFFAOYSA-N
XLogP2.18
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(4-tert-butylpiperidin-4-yl)methyl]-5-fluoropyridine
CID 172524037
1-[(5-fluoro-3-pyridinyl)methyl]-3,5-dimethylpiperazine
CID 104973765
1-[(5-fluoro-3-pyridinyl)methyl]-3,3-dimethylpiperazine
CID 104956316
2-(3-fluorophenyl)-1-[(5-fluoro-3-pyridinyl)methyl]piperazine
CID 120768574
4-[(5-fluoro-3-pyridinyl)methyl]-2-methylthiomorpholine
CID 126789555
(3aR,6aS)-5-[(5-fluoro-3-pyridinyl)methyl]-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;hydrochloride
CID 120660916
3-ethyl-1-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-1,4-diazepane
CID 114084807
1-[2-(5-fluoro-3-pyridinyl)ethyl]piperazine
CID 82507856
3-[[(2S)-4,4-dimethylazetidin-2-yl]methyl]-5-fluoropyridine
CID 155694847
2-(3-chlorophenyl)-1-[(5-fluoro-3-pyridinyl)methyl]piperazine;hydrochloride
CID 120780146
[1-[(5-fluoro-3-pyridinyl)methyl]piperidin-2-yl]methanamine
CID 104973692
1-[(5-fluoro-3-pyridinyl)methyl]cyclopentan-1-amine
CID 130515276

Frequently Asked Questions

What is the IUPAC name of 2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane (CID 154761920) is 2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane is CC1CC2(CCNCC2)CN1Cc1cncc(F)c1.
What is the InChIKey of 2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane?
The InChIKey is JEVOKBXUSWRUMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3/c1-12-7-15(2-4-17-5-3-15)11-19(12)10-13-6-14(16)9-18-8-13/h6,8-9,12,17H,2-5,7,10-11H2,1H3.
What are the key properties of 2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane?
2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane has a molecular weight of 263.36 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-fluoro-3-pyridinyl)methyl]-3-methyl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 154761920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).