[2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol

C23H25NO — CID 2854401

IUPAC[2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol
SMILESCC(c1ccccc1C(O)(c1ccccc1)c1ccccc1)N(C)C
InChIInChI=1S/C23H25NO/c1-18(24(2)3)21-16-10-11-17-22(21)23(25,19-12-6-4-7-13-19)20-14-8-5-9-15-20/h4-18,25H,1-3H3
InChIKeyIFQPCBJQWBPSDY-UHFFFAOYSA-N
MW331.46 g/mol
LogP4.59
Rot. Bonds5

About [2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol

[2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol (PubChem CID 2854401) has the molecular formula C23H25NO and a molecular weight of 331.46 g/mol. Its IUPAC name is [2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol.

Molecular Properties

Compound Name[2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol
PubChem CID2854401
Molecular FormulaC23H25NO
Molecular Weight331.46 g/mol
Exact Mass331.19
IUPAC Name[2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol
SMILESCC(c1ccccc1C(O)(c1ccccc1)c1ccccc1)N(C)C
InChIInChI=1S/C23H25NO/c1-18(24(2)3)21-16-10-11-17-22(21)23(25,19-12-6-4-7-13-19)20-14-8-5-9-15-20/h4-18,25H,1-3H3
InChIKeyIFQPCBJQWBPSDY-UHFFFAOYSA-N
XLogP4.59
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol?
The IUPAC name of [2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol (CID 2854401) is [2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol.
What is the SMILES notation for [2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol?
The canonical SMILES for [2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol is CC(c1ccccc1C(O)(c1ccccc1)c1ccccc1)N(C)C.
What is the InChIKey of [2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol?
The InChIKey is IFQPCBJQWBPSDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO/c1-18(24(2)3)21-16-10-11-17-22(21)23(25,19-12-6-4-7-13-19)20-14-8-5-9-15-20/h4-18,25H,1-3H3.
What are the key properties of [2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol?
[2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol has a molecular weight of 331.46 g/mol, XLogP of 4.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[1-(dimethylamino)ethyl]phenyl]-diphenylmethanol is sourced from PubChem (CID 2854401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).