N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide

C14H16N2OS — CID 110715989

IUPACN-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESCN(CCc1nccs1)C(=O)Cc1ccccc1
InChIInChI=1S/C14H16N2OS/c1-16(9-7-13-15-8-10-18-13)14(17)11-12-5-3-2-4-6-12/h2-6,8,10H,7,9,11H2,1H3
InChIKeyIFUCPJCOCKDRJP-UHFFFAOYSA-N
MW260.36 g/mol
LogP2.39
Rot. Bonds5

About N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide

N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide (PubChem CID 110715989) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
PubChem CID110715989
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC NameN-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESCN(CCc1nccs1)C(=O)Cc1ccccc1
InChIInChI=1S/C14H16N2OS/c1-16(9-7-13-15-8-10-18-13)14(17)11-12-5-3-2-4-6-12/h2-6,8,10H,7,9,11H2,1H3
InChIKeyIFUCPJCOCKDRJP-UHFFFAOYSA-N
XLogP2.39
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chlorophenyl)-N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
CID 110716038
2-(1H-indol-3-yl)-N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
CID 110742649
N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide
CID 110715967
3-ethyl-1-methyl-1-[2-(1,3-thiazol-2-yl)ethyl]urea
CID 75387967
4-(dimethylamino)-N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]benzamide
CID 110742660
2-phenyl-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 110442320
2-(4-methoxyphenyl)-N-methyl-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 110715683
N-methyl-N-[2-(methylamino)ethyl]-2-phenylacetamide
CID 23084464
3,4-dichloro-N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]benzamide
CID 110715983
N-cyclopentyl-2-phenyl-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 158834559
3-(3-fluorophenyl)-1-methyl-1-[2-(1,3-thiazol-2-yl)ethyl]urea
CID 71844410
N-methyl-3-[(2-phenylacetyl)amino]-N-(2-pyrimidin-2-ylethyl)propanamide
CID 138013236

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The IUPAC name of N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide (CID 110715989) is N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide.
What is the SMILES notation for N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The canonical SMILES for N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide is CN(CCc1nccs1)C(=O)Cc1ccccc1.
What is the InChIKey of N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
The InChIKey is IFUCPJCOCKDRJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-16(9-7-13-15-8-10-18-13)14(17)11-12-5-3-2-4-6-12/h2-6,8,10H,7,9,11H2,1H3.
What are the key properties of N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide?
N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide has a molecular weight of 260.36 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 110715989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).