2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide

C13H15N3OS — CID 18134023

IUPAC2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide
SMILESCN(CC(=O)Nc1nccs1)Cc1ccccc1
InChIInChI=1S/C13H15N3OS/c1-16(9-11-5-3-2-4-6-11)10-12(17)15-13-14-7-8-18-13/h2-8H,9-10H2,1H3,(H,14,15,17)
InChIKeyGANPTHZDEYHVPH-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.21
Rot. Bonds5

About 2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide

2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 18134023) has the molecular formula C13H15N3OS and a molecular weight of 261.35 g/mol. Its IUPAC name is 2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide
PubChem CID18134023
Molecular FormulaC13H15N3OS
Molecular Weight261.35 g/mol
Exact Mass261.09
IUPAC Name2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide
SMILESCN(CC(=O)Nc1nccs1)Cc1ccccc1
InChIInChI=1S/C13H15N3OS/c1-16(9-11-5-3-2-4-6-11)10-12(17)15-13-14-7-8-18-13/h2-8H,9-10H2,1H3,(H,14,15,17)
InChIKeyGANPTHZDEYHVPH-UHFFFAOYSA-N
XLogP2.21
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[methyl-[(4-methylphenyl)methyl]amino]-N-(1,3-thiazol-2-yl)acetamide
CID 18134036
2-[(4-tert-butylphenyl)methyl-methylamino]-N-(1,3-thiazol-2-yl)acetamide
CID 18134032
1-benzyl-1-methyl-3-(1,3-thiazol-2-yl)urea
CID 127514333
2-[furan-2-ylmethyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide
CID 18134048
2-[benzyl(methyl)amino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
CID 3072301
methyl 2-[methyl-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]amino]acetate
CID 60698118
1-benzyl-1-propan-2-yl-3-(1,3-thiazol-2-yl)urea
CID 47363759
2-benzylsulfonyl-N-(1,3-thiazol-2-yl)acetamide
CID 3158209
3-benzylsulfanyl-N-(1,3-thiazol-2-yl)propanamide
CID 6498108
N-(3-ethylphenyl)-2-[methyl(1,3-thiazol-2-ylmethyl)amino]acetamide
CID 126811732
1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea
CID 34880183
2-(3-methylphenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 6468138

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide (CID 18134023) is 2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide is CN(CC(=O)Nc1nccs1)Cc1ccccc1.
What is the InChIKey of 2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is GANPTHZDEYHVPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3OS/c1-16(9-11-5-3-2-4-6-11)10-12(17)15-13-14-7-8-18-13/h2-8H,9-10H2,1H3,(H,14,15,17).
What are the key properties of 2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide?
2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 261.35 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(methyl)amino]-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 18134023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).