N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide

C7H10N2OS — CID 61381257

IUPACN-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide
SMILESCC(=O)NCc1cnc(C)s1
InChIInChI=1S/C7H10N2OS/c1-5(10)8-3-7-4-9-6(2)11-7/h4H,3H2,1-2H3,(H,8,10)
InChIKeyXAYWUEISEWOHLY-UHFFFAOYSA-N
MW170.24 g/mol
LogP1.09
Rot. Bonds2

About N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide

N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide (PubChem CID 61381257) has the molecular formula C7H10N2OS and a molecular weight of 170.24 g/mol. Its IUPAC name is N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide
PubChem CID61381257
Molecular FormulaC7H10N2OS
Molecular Weight170.24 g/mol
Exact Mass170.05
IUPAC NameN-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide
SMILESCC(=O)NCc1cnc(C)s1
InChIInChI=1S/C7H10N2OS/c1-5(10)8-3-7-4-9-6(2)11-7/h4H,3H2,1-2H3,(H,8,10)
InChIKeyXAYWUEISEWOHLY-UHFFFAOYSA-N
XLogP1.09
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.24
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-((2-Chloro-5-thiazolyl)methyl)-N'-methylurea
CID 71372718
[(2-Chloro-1,3-thiazol-5-yl)methyl]urea
CID 53236471
[(2-Ethyl-1,3-thiazol-5-yl)methyl](methyl)amine
CID 50987848
N,2-Dimethyl-5-thiazolemethanamine
CID 20312952
N,2,2-trimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide
CID 121446729
(2-Methyl-1,3-thiazol-5-yl)methanamine
CID 19046689
(2-Ethyl-1,3-thiazol-5-yl)methanamine
CID 60983127
N,2-dimethyl-1,3-thiazole-5-carboxamide
CID 47002207
2-[methyl-[(2-methyl-1,3-thiazol-5-yl)methyl]amino]-N,N-dipropylacetamide
CID 52677539
N-ethyl-N-methyl-3-[methyl-[(2-methyl-1,3-thiazol-5-yl)methyl]amino]propanamide
CID 71846432
1-acetyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]azetidine-3-carboxamide
CID 92633115
1-{4-[(1,3-Thiazol-5-ylmethyl)amino]piperidin-1-yl}ethan-1-one
CID 62758882

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
The IUPAC name of N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide (CID 61381257) is N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide.
What is the SMILES notation for N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
The canonical SMILES for N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide is CC(=O)NCc1cnc(C)s1.
What is the InChIKey of N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
The InChIKey is XAYWUEISEWOHLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2OS/c1-5(10)8-3-7-4-9-6(2)11-7/h4H,3H2,1-2H3,(H,8,10).
What are the key properties of N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide has a molecular weight of 170.24 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide is sourced from PubChem (CID 61381257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).