[(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol

C10H19F2NO — CID 146286428

IUPAC[(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol
SMILESCC(C)C(C)N1CC(F)(F)C[C@@H]1CO
InChIInChI=1S/C10H19F2NO/c1-7(2)8(3)13-6-10(11,12)4-9(13)5-14/h7-9,14H,4-6H2,1-3H3/t8?,9-/m1/s1
InChIKeyUTSPCQXLQREKML-YGPZHTELSA-N
MW207.26 g/mol
LogP1.73
Rot. Bonds3

About [(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol

[(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol (PubChem CID 146286428) has the molecular formula C10H19F2NO and a molecular weight of 207.26 g/mol. Its IUPAC name is [(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol
PubChem CID146286428
Molecular FormulaC10H19F2NO
Molecular Weight207.26 g/mol
Exact Mass207.14
IUPAC Name[(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol
SMILESCC(C)C(C)N1CC(F)(F)C[C@@H]1CO
InChIInChI=1S/C10H19F2NO/c1-7(2)8(3)13-6-10(11,12)4-9(13)5-14/h7-9,14H,4-6H2,1-3H3/t8?,9-/m1/s1
InChIKeyUTSPCQXLQREKML-YGPZHTELSA-N
XLogP1.73
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1-Propylpyrrolidin-2-yl)methanol
CID 23383549
[(2S)-1-(2,2-difluoroethyl)pyrrolidin-2-yl]methanol
CID 64104040
[(2S)-1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]methanol
CID 121597861
[(2R)-1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]methanol
CID 10954178
[(2S)-1-(2,2-Dimethylpropyl)pyrrolidin-2-yl]methanol
CID 13425763
[(2S)-4,4-difluoro-1-methylpyrrolidin-2-yl]methanol
CID 60002546
((2S,4R)-4-Fluoro-1-methylpyrrolidin-2-yl)methanol
CID 60002592
[(2S,4S)-4-fluoro-1-methyl-pyrrolidin-2-yl]methanol
CID 60002610
[1-(2,2-Difluoroethyl)pyrrolidin-2-yl]methanol
CID 62013740
1-[(2R)-2-methyl-4-(trifluoromethyl)pyrrolidin-1-yl]propan-1-ol
CID 67851644
(1S)-2,2,2-trifluoro-1-[(2S)-1-[(3-propan-2-ylcyclobutyl)methyl]pyrrolidin-2-yl]ethanol
CID 68067721
[(2R)-4,4-difluoro-1-methylpyrrolidin-2-yl]methanol
CID 72207988

Frequently Asked Questions

What is the IUPAC name of [(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol (CID 146286428) is [(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol is CC(C)C(C)N1CC(F)(F)C[C@@H]1CO.
What is the InChIKey of [(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol?
The InChIKey is UTSPCQXLQREKML-YGPZHTELSA-N. The full InChI is InChI=1S/C10H19F2NO/c1-7(2)8(3)13-6-10(11,12)4-9(13)5-14/h7-9,14H,4-6H2,1-3H3/t8?,9-/m1/s1.
What are the key properties of [(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol?
[(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol has a molecular weight of 207.26 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-4,4-difluoro-1-(3-methylbutan-2-yl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 146286428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).