3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide

C17H22N2O2S — CID 110678896

IUPAC3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide
SMILESCc1nc(C)c(CCC(=O)Nc2ccccc2OC(C)C)s1
InChIInChI=1S/C17H22N2O2S/c1-11(2)21-15-8-6-5-7-14(15)19-17(20)10-9-16-12(3)18-13(4)22-16/h5-8,11H,9-10H2,1-4H3,(H,19,20)
InChIKeyIPFFLCVULQZXKQ-UHFFFAOYSA-N
MW318.44 g/mol
LogP4.12
Rot. Bonds6

About 3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide

3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide (PubChem CID 110678896) has the molecular formula C17H22N2O2S and a molecular weight of 318.44 g/mol. Its IUPAC name is 3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide.

Molecular Properties

Compound Name3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide
PubChem CID110678896
Molecular FormulaC17H22N2O2S
Molecular Weight318.44 g/mol
Exact Mass318.14
IUPAC Name3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide
SMILESCc1nc(C)c(CCC(=O)Nc2ccccc2OC(C)C)s1
InChIInChI=1S/C17H22N2O2S/c1-11(2)21-15-8-6-5-7-14(15)19-17(20)10-9-16-12(3)18-13(4)22-16/h5-8,11H,9-10H2,1-4H3,(H,19,20)
InChIKeyIPFFLCVULQZXKQ-UHFFFAOYSA-N
XLogP4.12
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.44
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,5-dimethylphenyl)-3-(2,4-dimethyl-1,3-thiazol-5-yl)propanamide
CID 110857318
3-(2-bromophenyl)-N-(2-propan-2-yloxyphenyl)propanamide
CID 55872825
2-(naphthalen-1-ylamino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 54809130
3-(2-methylpropylamino)-N-(2-propan-2-yloxyphenyl)propanamide
CID 109012857
3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-morpholin-4-ylphenyl)propanamide
CID 110678917
3-(2-aminophenyl)-N-(2-propan-2-yloxyphenyl)propanamide;hydrochloride
CID 120608791
N-(4-chloro-2-methylphenyl)-3-(2,4-dimethyl-1,3-thiazol-5-yl)propanamide
CID 110859212
3-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide
CID 110390667
3-(3,4-dimethoxyphenyl)-N-(2-propan-2-yloxyphenyl)propanamide
CID 38999781
4-(methylamino)-N-(2-propan-2-yloxyphenyl)butanamide;hydrochloride
CID 119714850
N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide
CID 108955532
2-propan-2-yloxy-N-(2-propan-2-yloxyphenyl)acetamide
CID 112687005

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide?
The IUPAC name of 3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide (CID 110678896) is 3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide.
What is the SMILES notation for 3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide?
The canonical SMILES for 3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide is Cc1nc(C)c(CCC(=O)Nc2ccccc2OC(C)C)s1.
What is the InChIKey of 3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide?
The InChIKey is IPFFLCVULQZXKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2S/c1-11(2)21-15-8-6-5-7-14(15)19-17(20)10-9-16-12(3)18-13(4)22-16/h5-8,11H,9-10H2,1-4H3,(H,19,20).
What are the key properties of 3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide?
3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide has a molecular weight of 318.44 g/mol, XLogP of 4.12, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(2-propan-2-yloxyphenyl)propanamide is sourced from PubChem (CID 110678896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).