(4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide

C20H22N2O3S — CID 97312987

IUPAC(4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide
SMILESCCOc1ccc(C(=O)N2CSC[C@H]2C(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C20H22N2O3S/c1-3-25-16-10-8-15(9-11-16)20(24)22-13-26-12-18(22)19(23)21-17-7-5-4-6-14(17)2/h4-11,18H,3,12-13H2,1-2H3,(H,21,23)/t18-/m0/s1
InChIKeyLNAYYQIDUHGDFR-SFHVURJKSA-N
MW370.47 g/mol
LogP3.55
Rot. Bonds5

About (4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide

(4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 97312987) has the molecular formula C20H22N2O3S and a molecular weight of 370.47 g/mol. Its IUPAC name is (4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name(4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide
PubChem CID97312987
Molecular FormulaC20H22N2O3S
Molecular Weight370.47 g/mol
Exact Mass370.14
IUPAC Name(4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide
SMILESCCOc1ccc(C(=O)N2CSC[C@H]2C(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C20H22N2O3S/c1-3-25-16-10-8-15(9-11-16)20(24)22-13-26-12-18(22)19(23)21-17-7-5-4-6-14(17)2/h4-11,18H,3,12-13H2,1-2H3,(H,21,23)/t18-/m0/s1
InChIKeyLNAYYQIDUHGDFR-SFHVURJKSA-N
XLogP3.55
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.47
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4S)-3-benzoyl-N-(2,4-dimethylphenyl)-1,3-thiazolidine-4-carboxamide
CID 97310871
(4R)-N-(2,3-dimethylphenyl)-3-(thiophene-3-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 95317689
(4R)-3-benzoyl-N-[4-(dimethylamino)-2-methylphenyl]-1,3-thiazolidine-4-carboxamide
CID 55940652
3-(4-tert-butylbenzoyl)-N-(2-fluorophenyl)-1,3-thiazolidine-4-carboxamide
CID 42745326
N-(2-methylphenyl)-3-(2-thiophen-2-ylacetyl)-1,3-thiazolidine-4-carboxamide
CID 122131672
3-(3,5-dimethoxybenzoyl)-N-(2-fluorophenyl)-1,3-thiazolidine-4-carboxamide
CID 42745754
tert-butyl (4R)-4-[(4-ethoxyphenyl)carbamoyl]-1,3-thiazolidine-3-carboxylate
CID 96564467
(4R)-3-[(2-methylphenyl)carbamoyl]-1,3-thiazolidine-4-carboxylic acid
CID 61196484
(4R)-3-benzoyl-N-[(4-phenylmethoxyphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 55938881
(4R)-3-benzoyl-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-1,3-thiazolidine-4-carboxamide
CID 55942505
4-(4-ethoxyphenyl)-N-(2-methylphenyl)-4-oxobutanamide
CID 880605
3-benzoyl-N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide
CID 51330773

Frequently Asked Questions

What is the IUPAC name of (4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of (4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide (CID 97312987) is (4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for (4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for (4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide is CCOc1ccc(C(=O)N2CSC[C@H]2C(=O)Nc2ccccc2C)cc1.
What is the InChIKey of (4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is LNAYYQIDUHGDFR-SFHVURJKSA-N. The full InChI is InChI=1S/C20H22N2O3S/c1-3-25-16-10-8-15(9-11-16)20(24)22-13-26-12-18(22)19(23)21-17-7-5-4-6-14(17)2/h4-11,18H,3,12-13H2,1-2H3,(H,21,23)/t18-/m0/s1.
What are the key properties of (4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide?
(4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 370.47 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3-(4-ethoxybenzoyl)-N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 97312987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).