(3R)-3-methylpyrrolidin-3-ol

C5H11NO — CID 55288331

IUPAC(3R)-3-methylpyrrolidin-3-ol
SMILESC[C@@]1(O)CCNC1
InChIInChI=1S/C5H11NO/c1-5(7)2-3-6-4-5/h6-7H,2-4H2,1H3/t5-/m1/s1
InChIKeyILBDVRCFTYQLOE-RXMQYKEDSA-N
MW101.15 g/mol
LogP-0.27
Rot. Bonds

About (3R)-3-methylpyrrolidin-3-ol

(3R)-3-methylpyrrolidin-3-ol (PubChem CID 55288331) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is (3R)-3-methylpyrrolidin-3-ol.

Molecular Properties

Compound Name(3R)-3-methylpyrrolidin-3-ol
PubChem CID55288331
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name(3R)-3-methylpyrrolidin-3-ol
SMILESC[C@@]1(O)CCNC1
InChIInChI=1S/C5H11NO/c1-5(7)2-3-6-4-5/h6-7H,2-4H2,1H3/t5-/m1/s1
InChIKeyILBDVRCFTYQLOE-RXMQYKEDSA-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 (3R)-3-methylpyrrolidin-3-ol?
The IUPAC name of (3R)-3-methylpyrrolidin-3-ol (CID 55288331) is (3R)-3-methylpyrrolidin-3-ol.
What is the SMILES notation for (3R)-3-methylpyrrolidin-3-ol?
The canonical SMILES for (3R)-3-methylpyrrolidin-3-ol is C[C@@]1(O)CCNC1.
What is the InChIKey of (3R)-3-methylpyrrolidin-3-ol?
The InChIKey is ILBDVRCFTYQLOE-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H11NO/c1-5(7)2-3-6-4-5/h6-7H,2-4H2,1H3/t5-/m1/s1.
What are the key properties of (3R)-3-methylpyrrolidin-3-ol?
(3R)-3-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 (3R)-3-methylpyrrolidin-3-ol is sourced from PubChem (CID 55288331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).