7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane

C15H21FN2 — CID 155982652

IUPAC7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane
SMILESCC1(C)CC2(CCCN2)CN1c1cccc(F)c1
InChIInChI=1S/C15H21FN2/c1-14(2)10-15(7-4-8-17-15)11-18(14)13-6-3-5-12(16)9-13/h3,5-6,9,17H,4,7-8,10-11H2,1-2H3
InChIKeyYHNMTOMXYABRPA-UHFFFAOYSA-N
MW248.34 g/mol
LogP2.94
Rot. Bonds1

About 7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane

7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane (PubChem CID 155982652) has the molecular formula C15H21FN2 and a molecular weight of 248.34 g/mol. Its IUPAC name is 7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane.

Molecular Properties

Compound Name7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane
PubChem CID155982652
Molecular FormulaC15H21FN2
Molecular Weight248.34 g/mol
Exact Mass248.17
IUPAC Name7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane
SMILESCC1(C)CC2(CCCN2)CN1c1cccc(F)c1
InChIInChI=1S/C15H21FN2/c1-14(2)10-15(7-4-8-17-15)11-18(14)13-6-3-5-12(16)9-13/h3,5-6,9,17H,4,7-8,10-11H2,1-2H3
InChIKeyYHNMTOMXYABRPA-UHFFFAOYSA-N
XLogP2.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.34
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-fluorophenyl)-[7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonan-1-yl]methanone
CID 155999720
4-(3-fluorophenyl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 64932927
(2,3-difluorophenyl)-[7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonan-1-yl]methanone
CID 155999715
3,3-diethyl-1-(3-fluorophenyl)piperazine
CID 64920188
3,3-difluoro-2-(3-fluorophenyl)-2-methylpiperidine
CID 115037049
[7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonan-1-yl]-(3-methoxyphenyl)methanone
CID 155999707
3,3-difluoro-2-(3-fluorophenyl)-2-methylpiperidine;hydrochloride
CID 115049370
4-[(3-fluorophenyl)methyl]-3,3-dimethyl-1,4-diazaspiro[5.5]undecane
CID 64875900
[7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonan-1-yl]-(4-methylpyrimidin-5-yl)methanone
CID 155999753
2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine
CID 117271498
1-(3-fluorophenyl)-7,7-dimethyl-1,5-diazocan-2-one
CID 117014978
[7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonan-1-yl]-(1-methyl-3-propylpyrazol-5-yl)methanone
CID 155999733

Frequently Asked Questions

What is the IUPAC name of 7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane?
The IUPAC name of 7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane (CID 155982652) is 7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane.
What is the SMILES notation for 7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane?
The canonical SMILES for 7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane is CC1(C)CC2(CCCN2)CN1c1cccc(F)c1.
What is the InChIKey of 7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane?
The InChIKey is YHNMTOMXYABRPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2/c1-14(2)10-15(7-4-8-17-15)11-18(14)13-6-3-5-12(16)9-13/h3,5-6,9,17H,4,7-8,10-11H2,1-2H3.
What are the key properties of 7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane?
7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane has a molecular weight of 248.34 g/mol, XLogP of 2.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-fluorophenyl)-8,8-dimethyl-1,7-diazaspiro[4.4]nonane is sourced from PubChem (CID 155982652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).