(2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide

C8H13F2NO3 — CID 103850586

IUPAC(2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide
SMILESO=C(NCC(O)C(F)F)[C@H]1CCCO1
InChIInChI=1S/C8H13F2NO3/c9-7(10)5(12)4-11-8(13)6-2-1-3-14-6/h5-7,12H,1-4H2,(H,11,13)/t5?,6-/m1/s1
InChIKeyRMUNUQMYBAXLAO-PRJDIBJQSA-N
MW209.19 g/mol
LogP-0.09
Rot. Bonds4

About (2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide

(2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide (PubChem CID 103850586) has the molecular formula C8H13F2NO3 and a molecular weight of 209.19 g/mol. Its IUPAC name is (2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide
PubChem CID103850586
Molecular FormulaC8H13F2NO3
Molecular Weight209.19 g/mol
Exact Mass209.09
IUPAC Name(2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide
SMILESO=C(NCC(O)C(F)F)[C@H]1CCCO1
InChIInChI=1S/C8H13F2NO3/c9-7(10)5(12)4-11-8(13)6-2-1-3-14-6/h5-7,12H,1-4H2,(H,11,13)/t5?,6-/m1/s1
InChIKeyRMUNUQMYBAXLAO-PRJDIBJQSA-N
XLogP-0.09
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.19
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,3-difluoro-2-hydroxypropyl)oxane-2-carboxamide
CID 103822648
N-[(2R)-2-hydroxypropyl]oxolane-2-carboxamide
CID 83031393
N-(2-hydroxypropyl)oxolane-2-carboxamide
CID 43392747
2-hydroxy-3-(oxolane-2-carbonylamino)propanoic acid
CID 66166616
(2R)-N-[2-methyl-3-(methylamino)propyl]oxolane-2-carboxamide
CID 104856434
(2S)-N-(2-hydroxy-4-methylpentyl)oxolane-2-carboxamide
CID 103873933
(2R)-N-(2-hydroxy-4-methylpentyl)oxolane-2-carboxamide
CID 103850592
N-(3-hydroxy-2-methylpropyl)oxolane-2-carboxamide
CID 65037062
(2R)-N-(2-amino-2-cyclopropylethyl)oxolane-2-carboxamide
CID 104856432
2-methyl-3-(oxolane-2-carbonylamino)propanoic acid
CID 53211445
2-methyl-3-[[(2R)-oxolane-2-carbonyl]amino]propanoic acid
CID 104855649
(2R)-N-(2-hydroxy-4,4-dimethylpentyl)oxolane-2-carboxamide
CID 103850233

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide?
The IUPAC name of (2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide (CID 103850586) is (2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide is O=C(NCC(O)C(F)F)[C@H]1CCCO1.
What is the InChIKey of (2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide?
The InChIKey is RMUNUQMYBAXLAO-PRJDIBJQSA-N. The full InChI is InChI=1S/C8H13F2NO3/c9-7(10)5(12)4-11-8(13)6-2-1-3-14-6/h5-7,12H,1-4H2,(H,11,13)/t5?,6-/m1/s1.
What are the key properties of (2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide?
(2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide has a molecular weight of 209.19 g/mol, XLogP of -0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3,3-difluoro-2-hydroxypropyl)oxolane-2-carboxamide is sourced from PubChem (CID 103850586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).