[(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone

C9H14FNO — CID 154357198

IUPAC[(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone
SMILESO=C(C1C[C@@H]1F)N1CCCCC1
InChIInChI=1S/C9H14FNO/c10-8-6-7(8)9(12)11-4-2-1-3-5-11/h7-8H,1-6H2/t7?,8-/m0/s1
InChIKeyZDRFRVHCXOCBBW-MQWKRIRWSA-N
MW171.21 g/mol
LogP1.36
Rot. Bonds1

About [(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone

[(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone (PubChem CID 154357198) has the molecular formula C9H14FNO and a molecular weight of 171.21 g/mol. Its IUPAC name is [(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone
PubChem CID154357198
Molecular FormulaC9H14FNO
Molecular Weight171.21 g/mol
Exact Mass171.11
IUPAC Name[(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone
SMILESO=C(C1C[C@@H]1F)N1CCCCC1
InChIInChI=1S/C9H14FNO/c10-8-6-7(8)9(12)11-4-2-1-3-5-11/h7-8H,1-6H2/t7?,8-/m0/s1
InChIKeyZDRFRVHCXOCBBW-MQWKRIRWSA-N
XLogP1.36
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.21
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[(2R)-2-fluorocyclopropyl]-pyrrolidin-1-ylmethanone
CID 139324368
[2-(azepane-1-carbonyl)cyclopropyl]-(azepan-1-yl)methanone
CID 109140675
[2-(pyrrolidine-1-carbonyl)cyclopropyl]-pyrrolidin-1-ylmethanone
CID 109131791
trans-(1R,2R)-2-(piperidine-1-carbonyl)cyclopropane-1-carboxylic acid
CID 93311543
2-(azocane-1-carbonyl)cyclopropane-1-carboxylic acid
CID 60792176
cis-(1R,2S)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxylic acid
CID 93311514
azetidin-1-yl-(2-methylcyclopropyl)methanone
CID 91990919
[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]-piperidin-1-ylmethanone
CID 11871768
azepan-1-yl-[2-(trifluoromethyl)cyclohexyl]methanone
CID 115583695
cycloheptyl(pyrrolidin-1-yl)methanone
CID 62778687
cyclohexyl(piperidin-1-yl)methanone
CID 12760854
[(1S,2S)-2-ethenylcyclopropyl]-pyrrolidin-1-ylmethanone
CID 143898031

Frequently Asked Questions

What is the IUPAC name of [(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone?
The IUPAC name of [(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone (CID 154357198) is [(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone.
What is the SMILES notation for [(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone?
The canonical SMILES for [(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone is O=C(C1C[C@@H]1F)N1CCCCC1.
What is the InChIKey of [(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone?
The InChIKey is ZDRFRVHCXOCBBW-MQWKRIRWSA-N. The full InChI is InChI=1S/C9H14FNO/c10-8-6-7(8)9(12)11-4-2-1-3-5-11/h7-8H,1-6H2/t7?,8-/m0/s1.
What are the key properties of [(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone?
[(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone has a molecular weight of 171.21 g/mol, XLogP of 1.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-2-fluorocyclopropyl]-piperidin-1-ylmethanone is sourced from PubChem (CID 154357198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).