3-(1-pyrrolidin-3-ylpropan-2-yl)phenol

C13H19NO — CID 83908768

IUPAC3-(1-pyrrolidin-3-ylpropan-2-yl)phenol
SMILESCC(CC1CCNC1)c1cccc(O)c1
InChIInChI=1S/C13H19NO/c1-10(7-11-5-6-14-9-11)12-3-2-4-13(15)8-12/h2-4,8,10-11,14-15H,5-7,9H2,1H3
InChIKeyLQSAVYZHEWSJIG-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.50
Rot. Bonds3

About 3-(1-pyrrolidin-3-ylpropan-2-yl)phenol

3-(1-pyrrolidin-3-ylpropan-2-yl)phenol (PubChem CID 83908768) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 3-(1-pyrrolidin-3-ylpropan-2-yl)phenol.

Molecular Properties

Compound Name3-(1-pyrrolidin-3-ylpropan-2-yl)phenol
PubChem CID83908768
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name3-(1-pyrrolidin-3-ylpropan-2-yl)phenol
SMILESCC(CC1CCNC1)c1cccc(O)c1
InChIInChI=1S/C13H19NO/c1-10(7-11-5-6-14-9-11)12-3-2-4-13(15)8-12/h2-4,8,10-11,14-15H,5-7,9H2,1H3
InChIKeyLQSAVYZHEWSJIG-UHFFFAOYSA-N
XLogP2.50
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(1-pyrrolidin-3-ylpropan-2-yl)phenol 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

(3R)-3-[(2R)-2-phenylpropyl]pyrrolidine
CID 86324114
(3S)-3-[(2S)-2-(3-methoxyphenyl)propyl]pyrrolidine
CID 58422845
2-(1-pyrrolidin-3-ylpropan-2-yl)phenol
CID 83908767
3-(1-pyrrolidin-3-ylpropan-2-yl)pyridine
CID 83907317
3-[2-(4-methylphenyl)propyl]pyrrolidine
CID 83908593
3-[2-(3-methoxyphenyl)propyl]piperidine
CID 105493506
4-(1-pyrrolidin-3-ylpropan-2-yl)pyridine
CID 83907315
3-[2-(4-chloro-3-fluorophenyl)propyl]pyrrolidine
CID 83912664
3-[2-(azepan-4-yl)-1-hydroxyethyl]phenol
CID 84698860
N-[1-(3-hydroxyphenyl)ethyl]-2-piperidin-3-ylacetamide
CID 62676485
3-[amino(pyrrolidin-3-yl)methyl]phenol
CID 105446386
3-(pyrrolidin-3-ylmethylsulfonyl)phenol
CID 84702715

Frequently Asked Questions

What is the IUPAC name of 3-(1-pyrrolidin-3-ylpropan-2-yl)phenol?
The IUPAC name of 3-(1-pyrrolidin-3-ylpropan-2-yl)phenol (CID 83908768) is 3-(1-pyrrolidin-3-ylpropan-2-yl)phenol.
What is the SMILES notation for 3-(1-pyrrolidin-3-ylpropan-2-yl)phenol?
The canonical SMILES for 3-(1-pyrrolidin-3-ylpropan-2-yl)phenol is CC(CC1CCNC1)c1cccc(O)c1.
What is the InChIKey of 3-(1-pyrrolidin-3-ylpropan-2-yl)phenol?
The InChIKey is LQSAVYZHEWSJIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10(7-11-5-6-14-9-11)12-3-2-4-13(15)8-12/h2-4,8,10-11,14-15H,5-7,9H2,1H3.
What are the key properties of 3-(1-pyrrolidin-3-ylpropan-2-yl)phenol?
3-(1-pyrrolidin-3-ylpropan-2-yl)phenol has a molecular weight of 205.30 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-pyrrolidin-3-ylpropan-2-yl)phenol is sourced from PubChem (CID 83908768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).