(3,3-difluorocyclobutyl)-piperidin-1-ylmethanone

C10H15F2NO — CID 131196465

IUPAC(3,3-difluorocyclobutyl)-piperidin-1-ylmethanone
SMILESO=C(C1CC(F)(F)C1)N1CCCCC1
InChIInChI=1S/C10H15F2NO/c11-10(12)6-8(7-10)9(14)13-4-2-1-3-5-13/h8H,1-7H2
InChIKeyLFMMOQHJIBOJQJ-UHFFFAOYSA-N
MW203.23 g/mol
LogP2.04
Rot. Bonds1

About (3,3-difluorocyclobutyl)-piperidin-1-ylmethanone

(3,3-difluorocyclobutyl)-piperidin-1-ylmethanone (PubChem CID 131196465) has the molecular formula C10H15F2NO and a molecular weight of 203.23 g/mol. Its IUPAC name is (3,3-difluorocyclobutyl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(3,3-difluorocyclobutyl)-piperidin-1-ylmethanone
PubChem CID131196465
Molecular FormulaC10H15F2NO
Molecular Weight203.23 g/mol
Exact Mass203.11
IUPAC Name(3,3-difluorocyclobutyl)-piperidin-1-ylmethanone
SMILESO=C(C1CC(F)(F)C1)N1CCCCC1
InChIInChI=1S/C10H15F2NO/c11-10(12)6-8(7-10)9(14)13-4-2-1-3-5-13/h8H,1-7H2
InChIKeyLFMMOQHJIBOJQJ-UHFFFAOYSA-N
XLogP2.04
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.23
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[(3S)-3-aminopiperidin-1-yl]-(3,3-difluorocyclobutyl)methanone;hydrochloride
CID 166595294
[3-(aminomethyl)piperidin-1-yl]-(3,3-difluorocyclobutyl)methanone;hydrochloride
CID 166595296
(3,3-difluorocyclobutyl)-[7-(pyrrolidine-1-carbonyl)-1,2,4,5-tetrahydropyrrolo[1,2-d][1,4]diazepin-3-yl]methanone
CID 131691207
cycloheptyl(pyrrolidin-1-yl)methanone
CID 62778687
cyclohexyl(piperidin-1-yl)methanone
CID 12760854
(3,3-difluorocyclobutyl)-[(3S)-3-(methylamino)pyrrolidin-1-yl]methanone
CID 172646215
(3,3-difluorocyclobutyl)-(6-methyl-2,6-diazaspiro[3.3]heptan-2-yl)methanone
CID 176702301
[(3R,4R)-3-tert-butyl-4-fluoropyrrolidin-1-yl]-(3,3-difluorocyclobutyl)methanone
CID 155261572
1-(3,3-difluorocyclobutanecarbonyl)-4-methylpiperidine-3-carboxylic acid
CID 128922387
[4-(azepane-1-carbonyl)piperidin-1-yl]-cyclopentylmethanone
CID 134029844
1-[2-(3,3-difluorocyclobutanecarbonyl)-2,7-diazaspiro[3.4]octan-7-yl]-2-methylpropan-1-one
CID 131684089
(3,3-difluorocyclohexyl)-[4-(methylamino)piperidin-1-yl]methanone
CID 114226093

Frequently Asked Questions

What is the IUPAC name of (3,3-difluorocyclobutyl)-piperidin-1-ylmethanone?
The IUPAC name of (3,3-difluorocyclobutyl)-piperidin-1-ylmethanone (CID 131196465) is (3,3-difluorocyclobutyl)-piperidin-1-ylmethanone.
What is the SMILES notation for (3,3-difluorocyclobutyl)-piperidin-1-ylmethanone?
The canonical SMILES for (3,3-difluorocyclobutyl)-piperidin-1-ylmethanone is O=C(C1CC(F)(F)C1)N1CCCCC1.
What is the InChIKey of (3,3-difluorocyclobutyl)-piperidin-1-ylmethanone?
The InChIKey is LFMMOQHJIBOJQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F2NO/c11-10(12)6-8(7-10)9(14)13-4-2-1-3-5-13/h8H,1-7H2.
What are the key properties of (3,3-difluorocyclobutyl)-piperidin-1-ylmethanone?
(3,3-difluorocyclobutyl)-piperidin-1-ylmethanone has a molecular weight of 203.23 g/mol, XLogP of 2.04, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-difluorocyclobutyl)-piperidin-1-ylmethanone is sourced from PubChem (CID 131196465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).