N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide

C15H17ClN2OS — CID 110650032

IUPACN-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide
SMILESCC(C)c1csc(CCC(=O)Nc2ccc(Cl)cc2)n1
InChIInChI=1S/C15H17ClN2OS/c1-10(2)13-9-20-15(18-13)8-7-14(19)17-12-5-3-11(16)4-6-12/h3-6,9-10H,7-8H2,1-2H3,(H,17,19)
InChIKeyFAZYXQYWGUSWGE-UHFFFAOYSA-N
MW308.83 g/mol
LogP4.49
Rot. Bonds5

About N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide

N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide (PubChem CID 110650032) has the molecular formula C15H17ClN2OS and a molecular weight of 308.83 g/mol. Its IUPAC name is N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide
PubChem CID110650032
Molecular FormulaC15H17ClN2OS
Molecular Weight308.83 g/mol
Exact Mass308.08
IUPAC NameN-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide
SMILESCC(C)c1csc(CCC(=O)Nc2ccc(Cl)cc2)n1
InChIInChI=1S/C15H17ClN2OS/c1-10(2)13-9-20-15(18-13)8-7-14(19)17-12-5-3-11(16)4-6-12/h3-6,9-10H,7-8H2,1-2H3,(H,17,19)
InChIKeyFAZYXQYWGUSWGE-UHFFFAOYSA-N
XLogP4.49
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.83
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[3-(4-propan-2-yl-1,3-thiazol-2-yl)propanoylamino]benzoate
CID 110409557
N-(3-methylbutyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide
CID 110649255
N-[2-(2-fluorophenyl)ethyl]-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide
CID 110648392
1-(3-chlorophenyl)-3-[2-(4-propan-2-yl-1,3-thiazol-2-yl)ethyl]urea
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N-(4-ethylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 110388497
2-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-(4-chlorophenyl)acetamide
CID 43244296
N-(4-chlorophenyl)-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)propanamide
CID 110330056
3-(1,3-benzothiazol-2-yl)-N-(4-propan-2-ylphenyl)propanamide
CID 24641041
3-(dimethylamino)-N-[2-(4-propan-2-yl-1,3-thiazol-2-yl)ethyl]propanamide
CID 110442482
3-(2-amino-1,3-thiazol-4-yl)-N-[2-(4-propan-2-yl-1,3-thiazol-2-yl)ethyl]propanamide
CID 131951418
N-(4-methoxyphenyl)-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide
CID 110650248
3-(4-methyl-1,3-thiazol-2-yl)-N-(4-pyrrolidin-1-ylphenyl)propanamide
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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide (CID 110650032) is N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide is CC(C)c1csc(CCC(=O)Nc2ccc(Cl)cc2)n1.
What is the InChIKey of N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide?
The InChIKey is FAZYXQYWGUSWGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2OS/c1-10(2)13-9-20-15(18-13)8-7-14(19)17-12-5-3-11(16)4-6-12/h3-6,9-10H,7-8H2,1-2H3,(H,17,19).
What are the key properties of N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide?
N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide has a molecular weight of 308.83 g/mol, XLogP of 4.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-3-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 110650032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).