4-fluoro-8-azaspiro[4.5]decan-4-amine

C9H17FN2 — CID 141454971

IUPAC4-fluoro-8-azaspiro[4.5]decan-4-amine
SMILESNC1(F)CCCC12CCNCC2
InChIInChI=1S/C9H17FN2/c10-9(11)3-1-2-8(9)4-6-12-7-5-8/h12H,1-7,11H2
InChIKeyLADPHHIWBWZFBQ-UHFFFAOYSA-N
MW172.25 g/mol
LogP1.16
Rot. Bonds

About 4-fluoro-8-azaspiro[4.5]decan-4-amine

4-fluoro-8-azaspiro[4.5]decan-4-amine (PubChem CID 141454971) has the molecular formula C9H17FN2 and a molecular weight of 172.25 g/mol. Its IUPAC name is 4-fluoro-8-azaspiro[4.5]decan-4-amine.

Molecular Properties

Compound Name4-fluoro-8-azaspiro[4.5]decan-4-amine
PubChem CID141454971
Molecular FormulaC9H17FN2
Molecular Weight172.25 g/mol
Exact Mass172.14
IUPAC Name4-fluoro-8-azaspiro[4.5]decan-4-amine
SMILESNC1(F)CCCC12CCNCC2
InChIInChI=1S/C9H17FN2/c10-9(11)3-1-2-8(9)4-6-12-7-5-8/h12H,1-7,11H2
InChIKeyLADPHHIWBWZFBQ-UHFFFAOYSA-N
XLogP1.16
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.25
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze 4-fluoro-8-azaspiro[4.5]decan-4-amine 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

11,11-difluoro-3-azaspiro[5.5]undecane
CID 135392962
7-azadispiro[3.0.45.34]dodecane
CID 83905512
ethane;4-fluoro-4-methylpiperidine
CID 142139578
4,4-difluoropiperidine;methane
CID 143607085
6-azadispiro[2.0.44.43]dodecane
CID 83905513
4-methoxypiperidin-4-amine
CID 105427555
5,5,8,8-tetramethyl-azacycloundecane
CID 154959364
1,1,2,2-tetrafluoro-6-azaspiro[2.5]octane;hydrochloride
CID 122163593
3-fluoropyrrolidine-3-carbaldehyde
CID 89379154
2-(4-fluoropiperidin-4-yl)ethanamine
CID 84731210
3,3-diethyl-2,7-diazaspiro[3.5]nonane;formamide
CID 155267148
6,6-dimethyl-1,4-diazocane
CID 139442519

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-8-azaspiro[4.5]decan-4-amine?
The IUPAC name of 4-fluoro-8-azaspiro[4.5]decan-4-amine (CID 141454971) is 4-fluoro-8-azaspiro[4.5]decan-4-amine.
What is the SMILES notation for 4-fluoro-8-azaspiro[4.5]decan-4-amine?
The canonical SMILES for 4-fluoro-8-azaspiro[4.5]decan-4-amine is NC1(F)CCCC12CCNCC2.
What is the InChIKey of 4-fluoro-8-azaspiro[4.5]decan-4-amine?
The InChIKey is LADPHHIWBWZFBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17FN2/c10-9(11)3-1-2-8(9)4-6-12-7-5-8/h12H,1-7,11H2.
What are the key properties of 4-fluoro-8-azaspiro[4.5]decan-4-amine?
4-fluoro-8-azaspiro[4.5]decan-4-amine has a molecular weight of 172.25 g/mol, XLogP of 1.16, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-8-azaspiro[4.5]decan-4-amine is sourced from PubChem (CID 141454971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).