2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine

C9H18F2N2 — CID 84664108

IUPAC2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine
SMILESCC(F)(F)CN1CCCC1CCN
InChIInChI=1S/C9H18F2N2/c1-9(10,11)7-13-6-2-3-8(13)4-5-12/h8H,2-7,12H2,1H3
InChIKeyCHGUWUHPGDPFOG-UHFFFAOYSA-N
MW192.25 g/mol
LogP1.45
Rot. Bonds4

About 2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine

2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine (PubChem CID 84664108) has the molecular formula C9H18F2N2 and a molecular weight of 192.25 g/mol. Its IUPAC name is 2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine
PubChem CID84664108
Molecular FormulaC9H18F2N2
Molecular Weight192.25 g/mol
Exact Mass192.14
IUPAC Name2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine
SMILESCC(F)(F)CN1CCCC1CCN
InChIInChI=1S/C9H18F2N2/c1-9(10,11)7-13-6-2-3-8(13)4-5-12/h8H,2-7,12H2,1H3
InChIKeyCHGUWUHPGDPFOG-UHFFFAOYSA-N
XLogP1.45
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.25
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(3,3-difluorobutyl)piperidin-2-yl]ethanamine
CID 84685954
2-[1-(3,3-difluorobutyl)azepan-2-yl]ethanamine
CID 84697916
2-[1-(2-fluoroethyl)piperidin-2-yl]ethanamine
CID 80695108
1-[2-(aminomethyl)pyrrolidin-1-yl]-2-methylpropan-2-ol
CID 82503310
3-(1-ethylpyrrolidin-2-yl)propan-1-amine
CID 63763897
2-(3,3-dimethylbutyl)-1-ethylpyrrolidine
CID 58110544
2,2-dimethyl-3-(2-propylpiperidin-1-yl)propan-1-amine
CID 83056263
[1-(2,2,2-trifluoroethyl)piperidin-2-yl]methanamine
CID 43187045
2-(3-bromopropyl)-1-(2,2,2-trifluoroethyl)pyrrolidine
CID 80690357
2-methyl-2-[(2-propylpiperidin-1-yl)methyl]butan-1-amine
CID 83055635
2-(1-tert-butylazepan-2-yl)ethanamine
CID 84668474
2-[1-(3-amino-2,2-dimethylbutyl)piperidin-2-yl]ethanol
CID 66454911

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine?
The IUPAC name of 2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine (CID 84664108) is 2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine.
What is the SMILES notation for 2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine?
The canonical SMILES for 2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine is CC(F)(F)CN1CCCC1CCN.
What is the InChIKey of 2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine?
The InChIKey is CHGUWUHPGDPFOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18F2N2/c1-9(10,11)7-13-6-2-3-8(13)4-5-12/h8H,2-7,12H2,1H3.
What are the key properties of 2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine?
2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine has a molecular weight of 192.25 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,2-difluoropropyl)pyrrolidin-2-yl]ethanamine is sourced from PubChem (CID 84664108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).