(2R,3S)-2-methylpyrrolidin-3-ol

C5H11NO — CID 55287364

IUPAC(2R,3S)-2-methylpyrrolidin-3-ol
SMILESC[C@H]1NCC[C@@H]1O
InChIInChI=1S/C5H11NO/c1-4-5(7)2-3-6-4/h4-7H,2-3H2,1H3/t4-,5+/m1/s1
InChIKeyPNHQGHVFLXERHR-UHNVWZDZSA-N
MW101.15 g/mol
LogP-0.27
Rot. Bonds

About (2R,3S)-2-methylpyrrolidin-3-ol

(2R,3S)-2-methylpyrrolidin-3-ol (PubChem CID 55287364) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is (2R,3S)-2-methylpyrrolidin-3-ol.

Molecular Properties

Compound Name(2R,3S)-2-methylpyrrolidin-3-ol
PubChem CID55287364
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name(2R,3S)-2-methylpyrrolidin-3-ol
SMILESC[C@H]1NCC[C@@H]1O
InChIInChI=1S/C5H11NO/c1-4-5(7)2-3-6-4/h4-7H,2-3H2,1H3/t4-,5+/m1/s1
InChIKeyPNHQGHVFLXERHR-UHNVWZDZSA-N
XLogP-0.27
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3R)-2-methylpyrrolidin-3-ol;hydrochloride
CID 67314682
(2S,3R,4R)-2,3-dimethylpiperidin-4-ol
CID 7238900
(2S,3S)-2-methyl-3-(trifluoromethyl)pyrrolidine
CID 98041373
(2R,3S)-2-methylazetidin-3-ol;hydrochloride
CID 134691791
2,3-dimethylpyrrolidine;ethane
CID 90972313
(2S,3S)-2,3-dimethylpiperazine
CID 51614849
2-(hydroxymethyl)-3-methylpiperidin-4-ol
CID 77387082
(2R,3R)-2-methylpyrrolidine-3-carboxylic acid
CID 10887930
trihydroxy-(2-methylpyrrolidin-3-yl)silane
CID 69078558
(2S,3S)-2-tert-butylpyrrolidin-3-ol
CID 96636706
3-iodo-2-methylpyrrolidine
CID 118329704
(2S,3S,4R)-4-hydroxy-3-methylpiperidine-2-carboxylic acid
CID 15643990

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-methylpyrrolidin-3-ol?
The IUPAC name of (2R,3S)-2-methylpyrrolidin-3-ol (CID 55287364) is (2R,3S)-2-methylpyrrolidin-3-ol.
What is the SMILES notation for (2R,3S)-2-methylpyrrolidin-3-ol?
The canonical SMILES for (2R,3S)-2-methylpyrrolidin-3-ol is C[C@H]1NCC[C@@H]1O.
What is the InChIKey of (2R,3S)-2-methylpyrrolidin-3-ol?
The InChIKey is PNHQGHVFLXERHR-UHNVWZDZSA-N. The full InChI is InChI=1S/C5H11NO/c1-4-5(7)2-3-6-4/h4-7H,2-3H2,1H3/t4-,5+/m1/s1.
What are the key properties of (2R,3S)-2-methylpyrrolidin-3-ol?
(2R,3S)-2-methylpyrrolidin-3-ol has a molecular weight of 101.15 g/mol, XLogP of -0.27, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-methylpyrrolidin-3-ol is sourced from PubChem (CID 55287364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).