10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane

C9H17FN2 — CID 105435236

IUPAC10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane
SMILESCN1CCC(F)C2(CCNC2)C1
InChIInChI=1S/C9H17FN2/c1-12-5-2-8(10)9(7-12)3-4-11-6-9/h8,11H,2-7H2,1H3
InChIKeyXSLQHGWBIXHKGJ-UHFFFAOYSA-N
MW172.25 g/mol
LogP0.64
Rot. Bonds

About 10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane

10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane (PubChem CID 105435236) has the molecular formula C9H17FN2 and a molecular weight of 172.25 g/mol. Its IUPAC name is 10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane.

Molecular Properties

Compound Name10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane
PubChem CID105435236
Molecular FormulaC9H17FN2
Molecular Weight172.25 g/mol
Exact Mass172.14
IUPAC Name10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane
SMILESCN1CCC(F)C2(CCNC2)C1
InChIInChI=1S/C9H17FN2/c1-12-5-2-8(10)9(7-12)3-4-11-6-9/h8,11H,2-7H2,1H3
InChIKeyXSLQHGWBIXHKGJ-UHFFFAOYSA-N
XLogP0.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.25
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

tert-butyl 10-fluoro-2,7-diazaspiro[4.5]decane-7-carboxylate
CID 71305847
2-(1-methylpyrrolidin-3-yl)-5-azaspiro[2.4]heptane
CID 115015784
6,6-difluoro-2-methyl-2,9-diazaspiro[4.5]decane
CID 129230219
2-methyl-5-azaspiro[2.4]heptane
CID 91206231
2-methyl-2,7-diazaspiro[4.4]nonane;propane
CID 169170198
(5R,6R)-6-fluoro-2-(pyridin-4-ylmethyl)-2,9-diazaspiro[4.5]decane
CID 98778577
5-azaspiro[2.4]heptan-2-yl-(4-methylpiperazin-1-yl)methanone;ethane
CID 166116859
2,2-dimethylpropane;2-methyl-2,8-diazaspiro[4.5]decane
CID 145168180
6-methyl-2,8-diazaspiro[4.5]decane
CID 83680090
2-methyl-2,9-diazaspiro[4.5]decan-6-one
CID 82413175
5,5-difluoro-2-methyl-2,7-diazaspiro[3.5]nonane;dihydrochloride
CID 155895873
8-fluoro-6-azaspiro[2.5]octane
CID 84717106

Frequently Asked Questions

What is the IUPAC name of 10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane?
The IUPAC name of 10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane (CID 105435236) is 10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane.
What is the SMILES notation for 10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane?
The canonical SMILES for 10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane is CN1CCC(F)C2(CCNC2)C1.
What is the InChIKey of 10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane?
The InChIKey is XSLQHGWBIXHKGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17FN2/c1-12-5-2-8(10)9(7-12)3-4-11-6-9/h8,11H,2-7H2,1H3.
What are the key properties of 10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane?
10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane has a molecular weight of 172.25 g/mol, XLogP of 0.64, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-fluoro-7-methyl-2,7-diazaspiro[4.5]decane is sourced from PubChem (CID 105435236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).