(3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine

C8H15NO — CID 89369696

IUPAC(3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine
SMILESC=CC[C@]1(C)CCN(O)C1
InChIInChI=1S/C8H15NO/c1-3-4-8(2)5-6-9(10)7-8/h3,10H,1,4-7H2,2H3/t8-/m1/s1
InChIKeyMNWNAIDJLHKHBV-MRVPVSSYSA-N
MW141.21 g/mol
LogP1.66
Rot. Bonds2

About (3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine

(3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine (PubChem CID 89369696) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine.

Molecular Properties

Compound Name(3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine
PubChem CID89369696
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine
SMILESC=CC[C@]1(C)CCN(O)C1
InChIInChI=1S/C8H15NO/c1-3-4-8(2)5-6-9(10)7-8/h3,10H,1,4-7H2,2H3/t8-/m1/s1
InChIKeyMNWNAIDJLHKHBV-MRVPVSSYSA-N
XLogP1.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine?
The IUPAC name of (3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine (CID 89369696) is (3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine.
What is the SMILES notation for (3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine?
The canonical SMILES for (3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine is C=CC[C@]1(C)CCN(O)C1.
What is the InChIKey of (3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine?
The InChIKey is MNWNAIDJLHKHBV-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H15NO/c1-3-4-8(2)5-6-9(10)7-8/h3,10H,1,4-7H2,2H3/t8-/m1/s1.
What are the key properties of (3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine?
(3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine has a molecular weight of 141.21 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-hydroxy-3-methyl-3-prop-2-enylpyrrolidine is sourced from PubChem (CID 89369696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).