1-(methylamino)-1-phenylpropan-1-ol

C10H15NO — CID 19933884

IUPAC1-(methylamino)-1-phenylpropan-1-ol
SMILESCCC(O)(NC)c1ccccc1
InChIInChI=1S/C10H15NO/c1-3-10(12,11-2)9-7-5-4-6-8-9/h4-8,11-12H,3H2,1-2H3
InChIKeyLBAZTSIGFPGPIZ-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.46
Rot. Bonds3

About 1-(methylamino)-1-phenylpropan-1-ol

1-(methylamino)-1-phenylpropan-1-ol (PubChem CID 19933884) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-(methylamino)-1-phenylpropan-1-ol.

Molecular Properties

Compound Name1-(methylamino)-1-phenylpropan-1-ol
PubChem CID19933884
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name1-(methylamino)-1-phenylpropan-1-ol
SMILESCCC(O)(NC)c1ccccc1
InChIInChI=1S/C10H15NO/c1-3-10(12,11-2)9-7-5-4-6-8-9/h4-8,11-12H,3H2,1-2H3
InChIKeyLBAZTSIGFPGPIZ-UHFFFAOYSA-N
XLogP1.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 1-(methylamino)-1-phenylpropan-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

Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)-1-phenylpropan-1-ol?
The IUPAC name of 1-(methylamino)-1-phenylpropan-1-ol (CID 19933884) is 1-(methylamino)-1-phenylpropan-1-ol.
What is the SMILES notation for 1-(methylamino)-1-phenylpropan-1-ol?
The canonical SMILES for 1-(methylamino)-1-phenylpropan-1-ol is CCC(O)(NC)c1ccccc1.
What is the InChIKey of 1-(methylamino)-1-phenylpropan-1-ol?
The InChIKey is LBAZTSIGFPGPIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-3-10(12,11-2)9-7-5-4-6-8-9/h4-8,11-12H,3H2,1-2H3.
What are the key properties of 1-(methylamino)-1-phenylpropan-1-ol?
1-(methylamino)-1-phenylpropan-1-ol has a molecular weight of 165.24 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)-1-phenylpropan-1-ol is sourced from PubChem (CID 19933884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).