(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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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).