(3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine

C6H12F2N2 — CID 141191346

IUPAC(3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine
SMILESFC(F)CN[C@@H]1CCNC1
InChIInChI=1S/C6H12F2N2/c7-6(8)4-10-5-1-2-9-3-5/h5-6,9-10H,1-4H2/t5-/m1/s1
InChIKeyLDKLJNJMYQHIIZ-RXMQYKEDSA-N
MW150.17 g/mol
LogP0.20
Rot. Bonds3

About (3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine

(3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine (PubChem CID 141191346) has the molecular formula C6H12F2N2 and a molecular weight of 150.17 g/mol. Its IUPAC name is (3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine
PubChem CID141191346
Molecular FormulaC6H12F2N2
Molecular Weight150.17 g/mol
Exact Mass150.10
IUPAC Name(3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine
SMILESFC(F)CN[C@@H]1CCNC1
InChIInChI=1S/C6H12F2N2/c7-6(8)4-10-5-1-2-9-3-5/h5-6,9-10H,1-4H2/t5-/m1/s1
InChIKeyLDKLJNJMYQHIIZ-RXMQYKEDSA-N
XLogP0.20
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.17
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,2-difluoroethyl)azepan-4-amine
CID 84656479
N-(cyclopropylmethyl)pyrrolidin-3-amine
CID 53350336
N-(3,3,3-trifluoropropyl)pyrrolidin-3-amine
CID 79741324
(3R)-N-propan-2-ylpyrrolidin-3-amine
CID 53346611
(2S)-3-methyl-2-(pyrrolidin-3-ylamino)butan-1-ol
CID 79742166
N-prop-2-ynylpyrrolidin-3-amine;trihydrochloride
CID 175958246
1,1-difluoro-N-[(3R)-pyrrolidin-3-yl]methanesulfonamide
CID 79685509
(3S)-N-butylpyrrolidin-3-amine
CID 154470800
N-but-3-ynylpyrrolidin-3-amine
CID 79741791
(5S)-N-(2,2-difluoroethyl)bicyclo[3.1.0]hexan-3-amine
CID 144866331
N-methyl-2-(pyrrolidin-3-ylamino)ethanesulfonamide
CID 106333768
N-(2-cyclopropylsulfanylethyl)pyrrolidin-3-amine
CID 84660689

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine?
The IUPAC name of (3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine (CID 141191346) is (3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine.
What is the SMILES notation for (3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine?
The canonical SMILES for (3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine is FC(F)CN[C@@H]1CCNC1.
What is the InChIKey of (3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine?
The InChIKey is LDKLJNJMYQHIIZ-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H12F2N2/c7-6(8)4-10-5-1-2-9-3-5/h5-6,9-10H,1-4H2/t5-/m1/s1.
What are the key properties of (3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine?
(3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine has a molecular weight of 150.17 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(2,2-difluoroethyl)pyrrolidin-3-amine is sourced from PubChem (CID 141191346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).