2-[4-(ethylideneamino)phenyl]propan-2-ol

C11H15NO — CID 153345390

IUPAC2-[4-(ethylideneamino)phenyl]propan-2-ol
SMILESC/C=N/c1ccc(C(C)(C)O)cc1
InChIInChI=1S/C11H15NO/c1-4-12-10-7-5-9(6-8-10)11(2,3)13/h4-8,13H,1-3H3/b12-4+
InChIKeySLPXRRBOROMYLY-UUILKARUSA-N
MW177.25 g/mol
LogP2.64
Rot. Bonds2

About 2-[4-(ethylideneamino)phenyl]propan-2-ol

2-[4-(ethylideneamino)phenyl]propan-2-ol (PubChem CID 153345390) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-[4-(ethylideneamino)phenyl]propan-2-ol.

Molecular Properties

Compound Name2-[4-(ethylideneamino)phenyl]propan-2-ol
PubChem CID153345390
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name2-[4-(ethylideneamino)phenyl]propan-2-ol
SMILESC/C=N/c1ccc(C(C)(C)O)cc1
InChIInChI=1S/C11H15NO/c1-4-12-10-7-5-9(6-8-10)11(2,3)13/h4-8,13H,1-3H3/b12-4+
InChIKeySLPXRRBOROMYLY-UUILKARUSA-N
XLogP2.64
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 2-[4-(ethylideneamino)phenyl]propan-2-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 2-[4-(ethylideneamino)phenyl]propan-2-ol?
The IUPAC name of 2-[4-(ethylideneamino)phenyl]propan-2-ol (CID 153345390) is 2-[4-(ethylideneamino)phenyl]propan-2-ol.
What is the SMILES notation for 2-[4-(ethylideneamino)phenyl]propan-2-ol?
The canonical SMILES for 2-[4-(ethylideneamino)phenyl]propan-2-ol is C/C=N/c1ccc(C(C)(C)O)cc1.
What is the InChIKey of 2-[4-(ethylideneamino)phenyl]propan-2-ol?
The InChIKey is SLPXRRBOROMYLY-UUILKARUSA-N. The full InChI is InChI=1S/C11H15NO/c1-4-12-10-7-5-9(6-8-10)11(2,3)13/h4-8,13H,1-3H3/b12-4+.
What are the key properties of 2-[4-(ethylideneamino)phenyl]propan-2-ol?
2-[4-(ethylideneamino)phenyl]propan-2-ol has a molecular weight of 177.25 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(ethylideneamino)phenyl]propan-2-ol is sourced from PubChem (CID 153345390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).