4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide

C14H15ClN2OS — CID 47242346

IUPAC4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
SMILESCc1cnc(NC(=O)CCCc2ccc(Cl)cc2)s1
InChIInChI=1S/C14H15ClN2OS/c1-10-9-16-14(19-10)17-13(18)4-2-3-11-5-7-12(15)8-6-11/h5-9H,2-4H2,1H3,(H,16,17,18)
InChIKeyMZJMNEZKNXLCSK-UHFFFAOYSA-N
MW294.81 g/mol
LogP4.07
Rot. Bonds5

About 4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide

4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide (PubChem CID 47242346) has the molecular formula C14H15ClN2OS and a molecular weight of 294.81 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide.

Molecular Properties

Compound Name4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
PubChem CID47242346
Molecular FormulaC14H15ClN2OS
Molecular Weight294.81 g/mol
Exact Mass294.06
IUPAC Name4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
SMILESCc1cnc(NC(=O)CCCc2ccc(Cl)cc2)s1
InChIInChI=1S/C14H15ClN2OS/c1-10-9-16-14(19-10)17-13(18)4-2-3-11-5-7-12(15)8-6-11/h5-9H,2-4H2,1H3,(H,16,17,18)
InChIKeyMZJMNEZKNXLCSK-UHFFFAOYSA-N
XLogP4.07
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.81
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-chlorophenyl)sulfanyl-N-(5-methyl-1,3-thiazol-2-yl)butanamide
CID 2092099
3-(3-chloro-4-methylphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 24555170
3-chloro-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 16795655
3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 47378490
2-(2,4-dichlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 4852969
N-(5-methyl-1,3-thiazol-2-yl)-4-oxopentanamide
CID 65416516
4-(4-chlorophenyl)-N-(4-methyl-2-pyridinyl)butanamide
CID 47245712
4-[(6-chloro-2-pyridinyl)oxy]-N-(5-methyl-1,3-thiazol-2-yl)butanamide
CID 155553594
4-(4-ethoxyphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
CID 3343017
N-(5-methyl-1,3-thiazol-2-yl)-5-[2-[3-[4-[(5-methyl-1,3-thiazol-2-yl)amino]-4-oxobutyl]phenyl]phenyl]pentanamide
CID 146227869
4-(4-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)butanamide
CID 47246136
4-(2-methoxyethoxy)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
CID 60567543

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide?
The IUPAC name of 4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide (CID 47242346) is 4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide.
What is the SMILES notation for 4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide?
The canonical SMILES for 4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide is Cc1cnc(NC(=O)CCCc2ccc(Cl)cc2)s1.
What is the InChIKey of 4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide?
The InChIKey is MZJMNEZKNXLCSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2OS/c1-10-9-16-14(19-10)17-13(18)4-2-3-11-5-7-12(15)8-6-11/h5-9H,2-4H2,1H3,(H,16,17,18).
What are the key properties of 4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide?
4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide has a molecular weight of 294.81 g/mol, XLogP of 4.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)butanamide is sourced from PubChem (CID 47242346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).