2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine

C8H13F2N — CID 126845216

IUPAC2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine
SMILESCC1C(C2CCCN2)C1(F)F
InChIInChI=1S/C8H13F2N/c1-5-7(8(5,9)10)6-3-2-4-11-6/h5-7,11H,2-4H2,1H3
InChIKeyNETMTVQOMVZTFT-UHFFFAOYSA-N
MW161.19 g/mol
LogP1.64
Rot. Bonds1

About 2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine

2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine (PubChem CID 126845216) has the molecular formula C8H13F2N and a molecular weight of 161.19 g/mol. Its IUPAC name is 2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine.

Molecular Properties

Compound Name2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine
PubChem CID126845216
Molecular FormulaC8H13F2N
Molecular Weight161.19 g/mol
Exact Mass161.10
IUPAC Name2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine
SMILESCC1C(C2CCCN2)C1(F)F
InChIInChI=1S/C8H13F2N/c1-5-7(8(5,9)10)6-3-2-4-11-6/h5-7,11H,2-4H2,1H3
InChIKeyNETMTVQOMVZTFT-UHFFFAOYSA-N
XLogP1.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.19
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-cyclopentyl-2,2-difluorocyclopropyl)pyrrolidine
CID 126845474
2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-cyclohepta[b]pyridine;ethane
CID 142196659
2-(3-ethyl-2,2-difluorocyclopropyl)piperidine;hydrochloride
CID 126845345
3-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine
CID 126845218
2-[2,2-difluoro-3-(oxan-4-yl)cyclopropyl]piperidine;hydrochloride
CID 126845508
2-cyclopentylpyrrolidine
CID 4031549
(2S)-2-(2-methylcyclopropyl)pyrrolidine
CID 134335415
6-methyl-2-(5-methylcyclononyl)azonane
CID 146602825
2-pyrrolidin-2-ylpiperidine
CID 14810994
2,3,3a,4,5,6,7,7a-octahydro-1H-pyrrolo[3,2-b]pyridine
CID 58044710
2-(3,3-difluorocyclobutyl)azepane
CID 130834422
(4aR,9aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-pyrido[3,2-c]azepine
CID 82416494

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine?
The IUPAC name of 2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine (CID 126845216) is 2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine.
What is the SMILES notation for 2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine?
The canonical SMILES for 2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine is CC1C(C2CCCN2)C1(F)F.
What is the InChIKey of 2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine?
The InChIKey is NETMTVQOMVZTFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2N/c1-5-7(8(5,9)10)6-3-2-4-11-6/h5-7,11H,2-4H2,1H3.
What are the key properties of 2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine?
2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine has a molecular weight of 161.19 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-difluoro-3-methylcyclopropyl)pyrrolidine is sourced from PubChem (CID 126845216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).