(3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one

C6H10FNO2 — CID 175917678

IUPAC(3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one
SMILESCOC[C@]1(F)CCNC1=O
InChIInChI=1S/C6H10FNO2/c1-10-4-6(7)2-3-8-5(6)9/h2-4H2,1H3,(H,8,9)/t6-/m1/s1
InChIKeyJRGNBLSVXQNHQI-ZCFIWIBFSA-N
MW147.15 g/mol
LogP-0.14
Rot. Bonds2

About (3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one

(3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one (PubChem CID 175917678) has the molecular formula C6H10FNO2 and a molecular weight of 147.15 g/mol. Its IUPAC name is (3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name(3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one
PubChem CID175917678
Molecular FormulaC6H10FNO2
Molecular Weight147.15 g/mol
Exact Mass147.07
IUPAC Name(3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one
SMILESCOC[C@]1(F)CCNC1=O
InChIInChI=1S/C6H10FNO2/c1-10-4-6(7)2-3-8-5(6)9/h2-4H2,1H3,(H,8,9)/t6-/m1/s1
InChIKeyJRGNBLSVXQNHQI-ZCFIWIBFSA-N
XLogP-0.14
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.15
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(Methoxymethyl)pyrrolidin-2-one
CID 10351722
2-Oxa-6-azaspiro(3.4)octan-5-one
CID 130138944
N-(2,2,2-trifluoroethyl)oxolane-3-carboxamide
CID 126987345
3-fluoro-N-methyloxolane-3-carboxamide
CID 127003639
N-ethyl-3-fluorooxolane-3-carboxamide
CID 130709196
3-fluoro-N-propan-2-yloxolane-3-carboxamide
CID 131038892
(3R)-3-fluoro-3-(hydroxymethyl)pyrrolidin-2-one
CID 175917732
(3S)-3-fluoro-3-(hydroxymethyl)pyrrolidin-2-one
CID 175917734
Methyl 3-fluoro-2-oxo-3-pyrrolidinecarboxylate
CID 139201072
3-(2,2,2-Trifluoroethoxymethyl)pyrrolidin-2-one
CID 106706808
N-(2-fluoroethyl)-3-methyloxolane-3-carboxamide
CID 130635392
3-fluoro-N-(1-fluoropropan-2-yl)oxolane-3-carboxamide
CID 130666897

Frequently Asked Questions

What is the IUPAC name of (3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one?
The IUPAC name of (3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one (CID 175917678) is (3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one.
What is the SMILES notation for (3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one?
The canonical SMILES for (3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one is COC[C@]1(F)CCNC1=O.
What is the InChIKey of (3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one?
The InChIKey is JRGNBLSVXQNHQI-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H10FNO2/c1-10-4-6(7)2-3-8-5(6)9/h2-4H2,1H3,(H,8,9)/t6-/m1/s1.
What are the key properties of (3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one?
(3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one has a molecular weight of 147.15 g/mol, XLogP of -0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-fluoro-3-(methoxymethyl)pyrrolidin-2-one is sourced from PubChem (CID 175917678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).