1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol

C14H22N2O — CID 55131558

IUPAC1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol
SMILESCC(CN)(CN1CCC(O)C1)c1ccccc1
InChIInChI=1S/C14H22N2O/c1-14(10-15,12-5-3-2-4-6-12)11-16-8-7-13(17)9-16/h2-6,13,17H,7-11,15H2,1H3
InChIKeyZMVGXBQYOPNCTE-UHFFFAOYSA-N
MW234.34 g/mol
LogP0.97
Rot. Bonds4

About 1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol

1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol (PubChem CID 55131558) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol
PubChem CID55131558
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol
SMILESCC(CN)(CN1CCC(O)C1)c1ccccc1
InChIInChI=1S/C14H22N2O/c1-14(10-15,12-5-3-2-4-6-12)11-16-8-7-13(17)9-16/h2-6,13,17H,7-11,15H2,1H3
InChIKeyZMVGXBQYOPNCTE-UHFFFAOYSA-N
XLogP0.97
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-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

2-[1-(3-amino-2-methyl-2-phenylpropyl)piperidin-4-yl]oxyethanol
CID 82685523
3-(4-ethylpiperazin-1-yl)-2-methyl-2-phenylpropan-1-amine
CID 55051607
3-(3,4-dimethoxypyrrolidin-1-yl)-2-methyl-2-phenylpropan-1-amine
CID 103539187
[1-(3-amino-2-methyl-2-phenylpropyl)-3-methylpyrrolidin-2-yl]methanol
CID 102789630
1-[2-methyl-2-phenyl-3-(propan-2-ylamino)propyl]piperidin-4-ol
CID 62261469
3-(1,1-dioxo-1,4-thiazinan-4-yl)-2-methyl-2-phenylpropan-1-amine
CID 62257885
3-(3-methoxypiperidin-1-yl)-2-methyl-2-phenylpropan-1-ol
CID 102967569
3-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-phenylpropan-1-amine
CID 62329869
2-methyl-3-(3-methylpiperidin-1-yl)-2-phenylpropan-1-ol
CID 55055369
1-[2-(aminomethyl)-2-methylpentyl]pyrrolidin-3-ol
CID 62941187
1-(2-hydroxy-2,3-dimethylbutyl)pyrrolidin-3-ol
CID 114449091
2-phenyl-1-(3-phenylpyrrolidin-1-yl)propan-2-amine
CID 62488099

Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol?
The IUPAC name of 1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol (CID 55131558) is 1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol.
What is the SMILES notation for 1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol?
The canonical SMILES for 1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol is CC(CN)(CN1CCC(O)C1)c1ccccc1.
What is the InChIKey of 1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol?
The InChIKey is ZMVGXBQYOPNCTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-14(10-15,12-5-3-2-4-6-12)11-16-8-7-13(17)9-16/h2-6,13,17H,7-11,15H2,1H3.
What are the key properties of 1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol?
1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol has a molecular weight of 234.34 g/mol, XLogP of 0.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-2-methyl-2-phenylpropyl)pyrrolidin-3-ol is sourced from PubChem (CID 55131558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).