4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine

C11H19F2N — CID 126845300

IUPAC4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine
SMILESCC(C)C1C(C2CCNCC2)C1(F)F
InChIInChI=1S/C11H19F2N/c1-7(2)9-10(11(9,12)13)8-3-5-14-6-4-8/h7-10,14H,3-6H2,1-2H3
InChIKeyCTCZJKVXEJBBCU-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.52
Rot. Bonds2

About 4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine

4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine (PubChem CID 126845300) has the molecular formula C11H19F2N and a molecular weight of 203.28 g/mol. Its IUPAC name is 4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine.

Molecular Properties

Compound Name4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine
PubChem CID126845300
Molecular FormulaC11H19F2N
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Name4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine
SMILESCC(C)C1C(C2CCNCC2)C1(F)F
InChIInChI=1S/C11H19F2N/c1-7(2)9-10(11(9,12)13)8-3-5-14-6-4-8/h7-10,14H,3-6H2,1-2H3
InChIKeyCTCZJKVXEJBBCU-UHFFFAOYSA-N
XLogP2.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine;hydrochloride
CID 126845296
3-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine
CID 126845218
4-[(1R)-1-fluoroethyl]piperidine
CID 124547551
ethane;6-propan-2-yl-2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[c]pyridine
CID 164599271
3-(3-cyclopentyl-2,2-difluorocyclopropyl)pyrrolidine;hydrochloride
CID 126845475
3,3-difluoro-4-propan-2-ylpiperidine
CID 58394614
4-piperidin-4-ylpiperidine;trihydrochloride
CID 172779803
4-[(2R)-butan-2-yl]piperidine;ethane
CID 142032949
4-(2-iodopropyl)piperidine
CID 69040321
4-[(2S)-3-methylbutan-2-yl]piperidine
CID 126758303
(4S)-3,3-difluoro-4-propan-2-yloxypiperidine
CID 121261754
1-fluoro-1-piperidin-4-ylpropan-2-amine
CID 105431459

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine?
The IUPAC name of 4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine (CID 126845300) is 4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine.
What is the SMILES notation for 4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine?
The canonical SMILES for 4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine is CC(C)C1C(C2CCNCC2)C1(F)F.
What is the InChIKey of 4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine?
The InChIKey is CTCZJKVXEJBBCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F2N/c1-7(2)9-10(11(9,12)13)8-3-5-14-6-4-8/h7-10,14H,3-6H2,1-2H3.
What are the key properties of 4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine?
4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine has a molecular weight of 203.28 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-difluoro-3-propan-2-ylcyclopropyl)piperidine is sourced from PubChem (CID 126845300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).