[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol

C19H20N2OS — CID 59317090

IUPAC[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol
SMILESCN(C)Cc1cnc(C(O)(c2ccccc2)c2ccccc2)s1
InChIInChI=1S/C19H20N2OS/c1-21(2)14-17-13-20-18(23-17)19(22,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-13,22H,14H2,1-2H3
InChIKeyBQYNYWOQDFRCJE-UHFFFAOYSA-N
MW324.45 g/mol
LogP3.49
Rot. Bonds5

About [5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol

[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol (PubChem CID 59317090) has the molecular formula C19H20N2OS and a molecular weight of 324.45 g/mol. Its IUPAC name is [5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol.

Molecular Properties

Compound Name[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol
PubChem CID59317090
Molecular FormulaC19H20N2OS
Molecular Weight324.45 g/mol
Exact Mass324.13
IUPAC Name[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol
SMILESCN(C)Cc1cnc(C(O)(c2ccccc2)c2ccccc2)s1
InChIInChI=1S/C19H20N2OS/c1-21(2)14-17-13-20-18(23-17)19(22,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-13,22H,14H2,1-2H3
InChIKeyBQYNYWOQDFRCJE-UHFFFAOYSA-N
XLogP3.49
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol?
The IUPAC name of [5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol (CID 59317090) is [5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol.
What is the SMILES notation for [5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol?
The canonical SMILES for [5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol is CN(C)Cc1cnc(C(O)(c2ccccc2)c2ccccc2)s1.
What is the InChIKey of [5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol?
The InChIKey is BQYNYWOQDFRCJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2OS/c1-21(2)14-17-13-20-18(23-17)19(22,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-13,22H,14H2,1-2H3.
What are the key properties of [5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol?
[5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol has a molecular weight of 324.45 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(dimethylamino)methyl]-1,3-thiazol-2-yl]-diphenylmethanol is sourced from PubChem (CID 59317090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).