(2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone

C13H20F2N2O — CID 171415579

IUPAC(2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone
SMILESCC(C)N1CC2(CCN(C(=O)C3CC3(F)F)C2)C1
InChIInChI=1S/C13H20F2N2O/c1-9(2)17-7-12(8-17)3-4-16(6-12)11(18)10-5-13(10,14)15/h9-10H,3-8H2,1-2H3
InChIKeyOLYXZDSIODIXOH-UHFFFAOYSA-N
MW258.31 g/mol
LogP1.58
Rot. Bonds2

About (2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone

(2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone (PubChem CID 171415579) has the molecular formula C13H20F2N2O and a molecular weight of 258.31 g/mol. Its IUPAC name is (2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone.

Molecular Properties

Compound Name(2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone
PubChem CID171415579
Molecular FormulaC13H20F2N2O
Molecular Weight258.31 g/mol
Exact Mass258.15
IUPAC Name(2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone
SMILESCC(C)N1CC2(CCN(C(=O)C3CC3(F)F)C2)C1
InChIInChI=1S/C13H20F2N2O/c1-9(2)17-7-12(8-17)3-4-16(6-12)11(18)10-5-13(10,14)15/h9-10H,3-8H2,1-2H3
InChIKeyOLYXZDSIODIXOH-UHFFFAOYSA-N
XLogP1.58
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.31
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone 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

1-[2-(3,3-difluorocyclobutanecarbonyl)-2,7-diazaspiro[3.4]octan-7-yl]-2-methylpropan-1-one
CID 131684089
[(1R)-2,2-difluorocyclopropyl]-[(3S)-3-ethyl-3-methylpyrrolidin-1-yl]methanone
CID 147863064
2,2,2-trifluoro-1-(8-propan-2-yl-2,8-diazaspiro[3.5]nonan-2-yl)ethanone
CID 171415786
(2,2-difluorocyclopropyl)-(9-propan-2-yl-6-oxa-1,9-diazaspiro[4.5]decan-1-yl)methanone
CID 170572182
(2,2-difluorocyclopropyl)-(4-hydroxy-3-propan-2-yl-8-azaspiro[4.5]decan-8-yl)methanone
CID 137386971
ethane;piperidin-4-yl-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)methanone
CID 176934946
2-(propan-2-ylamino)-1-(2-propan-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone
CID 156517459
1-(6-propan-2-yl-2,6-diazaspiro[3.3]heptan-2-yl)-2-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 177010419
6-(difluoromethyl)-2-propan-2-yl-2-azaspiro[3.3]heptane;ethane
CID 172624374
2,2-difluoro-1-(9-propan-2-yl-2,9-diazaspiro[3.6]decan-2-yl)ethanone
CID 171415708
(3R)-1-[(1S)-2,2-dimethylcyclopropanecarbonyl]-3-propan-2-ylpyrrolidine-3-carboxylic acid
CID 129465596
(1-fluorocyclobutyl)-(11-propan-2-yl-8-oxa-3,11-diazaspiro[5.6]dodecan-3-yl)methanone
CID 131685131

Frequently Asked Questions

What is the IUPAC name of (2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone?
The IUPAC name of (2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone (CID 171415579) is (2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone.
What is the SMILES notation for (2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone?
The canonical SMILES for (2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone is CC(C)N1CC2(CCN(C(=O)C3CC3(F)F)C2)C1.
What is the InChIKey of (2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone?
The InChIKey is OLYXZDSIODIXOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20F2N2O/c1-9(2)17-7-12(8-17)3-4-16(6-12)11(18)10-5-13(10,14)15/h9-10H,3-8H2,1-2H3.
What are the key properties of (2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone?
(2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone has a molecular weight of 258.31 g/mol, XLogP of 1.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-difluorocyclopropyl)-(2-propan-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone is sourced from PubChem (CID 171415579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).