(1S)-1-[4-(dimethylamino)phenyl]ethanol

C10H15NO — CID 24766260

IUPAC(1S)-1-[4-(dimethylamino)phenyl]ethanol
SMILESC[C@H](O)c1ccc(N(C)C)cc1
InChIInChI=1S/C10H15NO/c1-8(12)9-4-6-10(7-5-9)11(2)3/h4-8,12H,1-3H3/t8-/m0/s1
InChIKeyBANBVMGOUBOEHA-QMMMGPOBSA-N
MW165.24 g/mol
LogP1.81
Rot. Bonds2

About (1S)-1-[4-(dimethylamino)phenyl]ethanol

(1S)-1-[4-(dimethylamino)phenyl]ethanol (PubChem CID 24766260) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is (1S)-1-[4-(dimethylamino)phenyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[4-(dimethylamino)phenyl]ethanol
PubChem CID24766260
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name(1S)-1-[4-(dimethylamino)phenyl]ethanol
SMILESC[C@H](O)c1ccc(N(C)C)cc1
InChIInChI=1S/C10H15NO/c1-8(12)9-4-6-10(7-5-9)11(2)3/h4-8,12H,1-3H3/t8-/m0/s1
InChIKeyBANBVMGOUBOEHA-QMMMGPOBSA-N
XLogP1.81
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1S)-1-[4-(dimethylamino)phenyl]ethanol?
The IUPAC name of (1S)-1-[4-(dimethylamino)phenyl]ethanol (CID 24766260) is (1S)-1-[4-(dimethylamino)phenyl]ethanol.
What is the SMILES notation for (1S)-1-[4-(dimethylamino)phenyl]ethanol?
The canonical SMILES for (1S)-1-[4-(dimethylamino)phenyl]ethanol is C[C@H](O)c1ccc(N(C)C)cc1.
What is the InChIKey of (1S)-1-[4-(dimethylamino)phenyl]ethanol?
The InChIKey is BANBVMGOUBOEHA-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H15NO/c1-8(12)9-4-6-10(7-5-9)11(2)3/h4-8,12H,1-3H3/t8-/m0/s1.
What are the key properties of (1S)-1-[4-(dimethylamino)phenyl]ethanol?
(1S)-1-[4-(dimethylamino)phenyl]ethanol has a molecular weight of 165.24 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[4-(dimethylamino)phenyl]ethanol is sourced from PubChem (CID 24766260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).