(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

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Related Compounds

(2R)-2-(1-methylimidazol-2-yl)sulfanyl-2-phenylacetamide
CID 94017809
2-[4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-2-phenylacetamide
CID 46690378
2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanol
CID 47024738
(2R)-2-(1-benzylimidazol-2-yl)sulfanyl-2-phenylacetamide
CID 41434046
1-(4-phenylpiperazin-1-yl)-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanone
CID 43018705
2-[(2-methyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenylacetamide
CID 86790555
2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetonitrile
CID 134010477
2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N,N-dimethyl-2-phenylacetamide
CID 55391479
2-[4-oxo-2-[[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylmethyl]quinazolin-3-yl]acetamide
CID 24606157
2-ethyl-5-[[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylmethyl]-1,3,4-oxadiazole
CID 134010479
2-phenyl-2-pyrimidin-2-ylsulfanylacetamide
CID 18136130
(2R)-2-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-2-phenylacetamide
CID 41438042

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).