[(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol

C7H15NO2 — CID 58778533

IUPAC[(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol
SMILESCO[C@H]1CCN(C)[C@@H]1CO
InChIInChI=1S/C7H15NO2/c1-8-4-3-7(10-2)6(8)5-9/h6-7,9H,3-5H2,1-2H3/t6-,7+/m1/s1
InChIKeyIKAKKPWHYIWFJV-RQJHMYQMSA-N
MW145.20 g/mol
LogP-0.30
Rot. Bonds2

About [(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol

[(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol (PubChem CID 58778533) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is [(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol
PubChem CID58778533
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name[(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol
SMILESCO[C@H]1CCN(C)[C@@H]1CO
InChIInChI=1S/C7H15NO2/c1-8-4-3-7(10-2)6(8)5-9/h6-7,9H,3-5H2,1-2H3/t6-,7+/m1/s1
InChIKeyIKAKKPWHYIWFJV-RQJHMYQMSA-N
XLogP-0.30
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-1-methyl-2-(methylsulfanyloxymethyl)pyrrolidine
CID 164904398
2-(hydroxymethyl)-1-methylpyrrolidin-3-ol
CID 20607201
(3-fluoro-1-methylpyrrolidin-2-yl)methanol
CID 163598879
(2R,3R,4R)-2-(hydroxymethyl)-1,4-dimethylpiperidin-3-ol
CID 164537384
(2R,3S)-2-(methoxymethyl)-1-methyl-3-propan-2-yloxypyrrolidine
CID 168880889
2-(methoxymethyl)-1-methyl-3-propan-2-yloxypyrrolidine
CID 168881366
1-(3-methoxy-1-methylpyrrolidin-2-yl)ethanone
CID 176999093
(2R,3R,4R)-1-tert-butyl-2-(hydroxymethyl)-4-methoxypiperidin-3-ol;bis(yttrium)
CID 172518109
2-(aminooxymethyl)-1-methylpyrrolidin-3-ol
CID 168881296
2-[(2S)-3-[tert-butyl(dimethyl)silyl]oxy-1-methylpyrrolidin-2-yl]ethanol
CID 59659457
2-[(2R,3R)-3-(hydroxymethyl)-1-methylpyrrolidin-2-yl]acetic acid
CID 170368031
[1-(1-methylpiperidin-4-yl)piperidin-4-yl]methanol
CID 83835284

Frequently Asked Questions

What is the IUPAC name of [(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol?
The IUPAC name of [(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol (CID 58778533) is [(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol is CO[C@H]1CCN(C)[C@@H]1CO.
What is the InChIKey of [(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol?
The InChIKey is IKAKKPWHYIWFJV-RQJHMYQMSA-N. The full InChI is InChI=1S/C7H15NO2/c1-8-4-3-7(10-2)6(8)5-9/h6-7,9H,3-5H2,1-2H3/t6-,7+/m1/s1.
What are the key properties of [(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol?
[(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol has a molecular weight of 145.20 g/mol, XLogP of -0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3S)-3-methoxy-1-methylpyrrolidin-2-yl]methanol is sourced from PubChem (CID 58778533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).