(1R)-1-pyrrolidin-2-ylprop-2-en-1-ol

C7H13NO — CID 142507396

IUPAC(1R)-1-pyrrolidin-2-ylprop-2-en-1-ol
SMILESC=C[C@@H](O)C1CCCN1
InChIInChI=1S/C7H13NO/c1-2-7(9)6-4-3-5-8-6/h2,6-9H,1,3-5H2/t6?,7-/m1/s1
InChIKeyDZMGPCIFXMBATE-COBSHVIPSA-N
MW127.19 g/mol
LogP0.29
Rot. Bonds2

About (1R)-1-pyrrolidin-2-ylprop-2-en-1-ol

(1R)-1-pyrrolidin-2-ylprop-2-en-1-ol (PubChem CID 142507396) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is (1R)-1-pyrrolidin-2-ylprop-2-en-1-ol.

Molecular Properties

Compound Name(1R)-1-pyrrolidin-2-ylprop-2-en-1-ol
PubChem CID142507396
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name(1R)-1-pyrrolidin-2-ylprop-2-en-1-ol
SMILESC=C[C@@H](O)C1CCCN1
InChIInChI=1S/C7H13NO/c1-2-7(9)6-4-3-5-8-6/h2,6-9H,1,3-5H2/t6?,7-/m1/s1
InChIKeyDZMGPCIFXMBATE-COBSHVIPSA-N
XLogP0.29
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (1R)-1-pyrrolidin-2-ylprop-2-en-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Iruleixilfztee-jgvffnpusa-
CID 11355528
5-Ethenylpyrrolidin-3-ol
CID 54557774
(1R)-1-[(2S)-pyrrolidin-2-yl]prop-2-en-1-ol
CID 55286758
(3S,5S)-5-(1-hydroxyethenyl)pyrrolidin-3-ol
CID 70259523
(5S)-5-(1-hydroxyethenyl)pyrrolidin-3-ol
CID 70306807
(3R,5S)-5-(1-hydroxyethenyl)pyrrolidin-3-ol
CID 89001665
(3R,5R)-5-prop-2-enylpyrrolidin-3-ol
CID 96005172
Acetylene;ethane;1-pyrrolidin-2-ylprop-2-en-1-ol
CID 142546446
8-Azabicyclo[3.2.1]oct-3-en-2-ol
CID 164122365
(1R)-1-[(2S)-4-methylidenepyrrolidin-2-yl]ethanol
CID 167304058
(1S)-1-[(2S)-1-methylpyrrolidin-2-yl]prop-2-en-1-ol
CID 168910900
(1R)-1-[(2S)-1-methylpyrrolidin-2-yl]prop-2-en-1-ol
CID 170089631

Frequently Asked Questions

What is the IUPAC name of (1R)-1-pyrrolidin-2-ylprop-2-en-1-ol?
The IUPAC name of (1R)-1-pyrrolidin-2-ylprop-2-en-1-ol (CID 142507396) is (1R)-1-pyrrolidin-2-ylprop-2-en-1-ol.
What is the SMILES notation for (1R)-1-pyrrolidin-2-ylprop-2-en-1-ol?
The canonical SMILES for (1R)-1-pyrrolidin-2-ylprop-2-en-1-ol is C=C[C@@H](O)C1CCCN1.
What is the InChIKey of (1R)-1-pyrrolidin-2-ylprop-2-en-1-ol?
The InChIKey is DZMGPCIFXMBATE-COBSHVIPSA-N. The full InChI is InChI=1S/C7H13NO/c1-2-7(9)6-4-3-5-8-6/h2,6-9H,1,3-5H2/t6?,7-/m1/s1.
What are the key properties of (1R)-1-pyrrolidin-2-ylprop-2-en-1-ol?
(1R)-1-pyrrolidin-2-ylprop-2-en-1-ol has a molecular weight of 127.19 g/mol, XLogP of 0.29, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-pyrrolidin-2-ylprop-2-en-1-ol is sourced from PubChem (CID 142507396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).