(2R)-4,4-difluoro-2-methyloxolane-2-carboxamide

C6H9F2NO2 — CID 162570093

IUPAC(2R)-4,4-difluoro-2-methyloxolane-2-carboxamide
SMILESC[C@]1(C(N)=O)CC(F)(F)CO1
InChIInChI=1S/C6H9F2NO2/c1-5(4(9)10)2-6(7,8)3-11-5/h2-3H2,1H3,(H2,9,10)/t5-/m1/s1
InChIKeyPALHTPPPPHIMJT-RXMQYKEDSA-N
MW165.14 g/mol
LogP0.29
Rot. Bonds1

About (2R)-4,4-difluoro-2-methyloxolane-2-carboxamide

(2R)-4,4-difluoro-2-methyloxolane-2-carboxamide (PubChem CID 162570093) has the molecular formula C6H9F2NO2 and a molecular weight of 165.14 g/mol. Its IUPAC name is (2R)-4,4-difluoro-2-methyloxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-4,4-difluoro-2-methyloxolane-2-carboxamide
PubChem CID162570093
Molecular FormulaC6H9F2NO2
Molecular Weight165.14 g/mol
Exact Mass165.06
IUPAC Name(2R)-4,4-difluoro-2-methyloxolane-2-carboxamide
SMILESC[C@]1(C(N)=O)CC(F)(F)CO1
InChIInChI=1S/C6H9F2NO2/c1-5(4(9)10)2-6(7,8)3-11-5/h2-3H2,1H3,(H2,9,10)/t5-/m1/s1
InChIKeyPALHTPPPPHIMJT-RXMQYKEDSA-N
XLogP0.29
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.14
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 4,4-difluoro-2-methyloxolane-2-carboxylate
CID 146444920
ethane;2-methyloxane-2-carboxamide
CID 171543445
(2S)-2-methyl-4-oxooxolane-2-carboxamide
CID 173184063
(2S)-2-methylmorpholine-2-carboxamide
CID 92632785
(2R)-2-methylmorpholine-2-carboxamide
CID 92632786
2-amino-3-methyl-1-[(2R)-2-methyloxiran-2-yl]butan-1-one
CID 87415294
2,5-diamino-1,4-dioxane-2,5-dicarboxamide
CID 163541428
(2S)-2-amino-4-methyl-1-(2-methyloxiran-2-yl)pentan-1-one;ethane;prop-1-ene
CID 144562151
3-propan-2-yloxolane-3-carboxamide
CID 170386865
1-hydroxy-3,3-dimethylcyclobutane-1-carboxamide
CID 127007168
3,3-difluoro-1-methylcyclobutane-1-carboxylic acid
CID 23446853
4,4-difluoro-2-methyl-1,3-dioxolane-2-carbonyl fluoride
CID 89135258

Frequently Asked Questions

What is the IUPAC name of (2R)-4,4-difluoro-2-methyloxolane-2-carboxamide?
The IUPAC name of (2R)-4,4-difluoro-2-methyloxolane-2-carboxamide (CID 162570093) is (2R)-4,4-difluoro-2-methyloxolane-2-carboxamide.
What is the SMILES notation for (2R)-4,4-difluoro-2-methyloxolane-2-carboxamide?
The canonical SMILES for (2R)-4,4-difluoro-2-methyloxolane-2-carboxamide is C[C@]1(C(N)=O)CC(F)(F)CO1.
What is the InChIKey of (2R)-4,4-difluoro-2-methyloxolane-2-carboxamide?
The InChIKey is PALHTPPPPHIMJT-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H9F2NO2/c1-5(4(9)10)2-6(7,8)3-11-5/h2-3H2,1H3,(H2,9,10)/t5-/m1/s1.
What are the key properties of (2R)-4,4-difluoro-2-methyloxolane-2-carboxamide?
(2R)-4,4-difluoro-2-methyloxolane-2-carboxamide has a molecular weight of 165.14 g/mol, XLogP of 0.29, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4,4-difluoro-2-methyloxolane-2-carboxamide is sourced from PubChem (CID 162570093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).