(2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide

C20H21N3OS — CID 41434250

IUPAC(2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide
SMILESCC(C)c1ccccc1-n1ccnc1S[C@@H](C(N)=O)c1ccccc1
InChIInChI=1S/C20H21N3OS/c1-14(2)16-10-6-7-11-17(16)23-13-12-22-20(23)25-18(19(21)24)15-8-4-3-5-9-15/h3-14,18H,1-2H3,(H2,21,24)/t18-/m1/s1
InChIKeyOWNZNRKZDWVACV-GOSISDBHSA-N
MW351.48 g/mol
LogP4.31
Rot. Bonds6

About (2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide

(2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide (PubChem CID 41434250) has the molecular formula C20H21N3OS and a molecular weight of 351.48 g/mol. Its IUPAC name is (2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide.

Molecular Properties

Compound Name(2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide
PubChem CID41434250
Molecular FormulaC20H21N3OS
Molecular Weight351.48 g/mol
Exact Mass351.14
IUPAC Name(2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide
SMILESCC(C)c1ccccc1-n1ccnc1S[C@@H](C(N)=O)c1ccccc1
InChIInChI=1S/C20H21N3OS/c1-14(2)16-10-6-7-11-17(16)23-13-12-22-20(23)25-18(19(21)24)15-8-4-3-5-9-15/h3-14,18H,1-2H3,(H2,21,24)/t18-/m1/s1
InChIKeyOWNZNRKZDWVACV-GOSISDBHSA-N
XLogP4.31
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.48
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide 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 (2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide?
The IUPAC name of (2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide (CID 41434250) is (2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide.
What is the SMILES notation for (2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide?
The canonical SMILES for (2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide is CC(C)c1ccccc1-n1ccnc1S[C@@H](C(N)=O)c1ccccc1.
What is the InChIKey of (2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide?
The InChIKey is OWNZNRKZDWVACV-GOSISDBHSA-N. The full InChI is InChI=1S/C20H21N3OS/c1-14(2)16-10-6-7-11-17(16)23-13-12-22-20(23)25-18(19(21)24)15-8-4-3-5-9-15/h3-14,18H,1-2H3,(H2,21,24)/t18-/m1/s1.
What are the key properties of (2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide?
(2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide has a molecular weight of 351.48 g/mol, XLogP of 4.31, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-phenyl-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide is sourced from PubChem (CID 41434250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).