N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide

C9H11F3N2O2S — CID 78892612

IUPACN-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide
SMILESCc1csc(N(C)C(=O)COCC(F)(F)F)n1
InChIInChI=1S/C9H11F3N2O2S/c1-6-4-17-8(13-6)14(2)7(15)3-16-5-9(10,11)12/h4H,3,5H2,1-2H3
InChIKeyUXKLWYQUYSGPBH-UHFFFAOYSA-N
MW268.26 g/mol
LogP1.99
Rot. Bonds4

About N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide

N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide (PubChem CID 78892612) has the molecular formula C9H11F3N2O2S and a molecular weight of 268.26 g/mol. Its IUPAC name is N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide.

Molecular Properties

Compound NameN-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide
PubChem CID78892612
Molecular FormulaC9H11F3N2O2S
Molecular Weight268.26 g/mol
Exact Mass268.05
IUPAC NameN-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide
SMILESCc1csc(N(C)C(=O)COCC(F)(F)F)n1
InChIInChI=1S/C9H11F3N2O2S/c1-6-4-17-8(13-6)14(2)7(15)3-16-5-9(10,11)12/h4H,3,5H2,1-2H3
InChIKeyUXKLWYQUYSGPBH-UHFFFAOYSA-N
XLogP1.99
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.26
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethyl)-4-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
CID 57960478
N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine
CID 88585181
2,2,2-Trifluoro-N-methyl-N-(4-methyl-thiazol-2-yl)-acetamide
CID 12954409
N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 45802599
2-(2-methoxyethoxy)-N-(4-methyl-1,3-thiazol-2-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 60581330
2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-N-(2,2,2-trifluoroethyl)propanamide
CID 75417152
2-(2-methoxyethoxy)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide
CID 78863568
2-methoxy-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide
CID 78863621
2-(2,2,2-trifluoroethoxy)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propanamide
CID 78872137
2-(2,2,2-trifluoroethoxy)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide
CID 78876267
2-(cyclopropylmethoxy)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide
CID 78876406
1-[4-(4-Methyl-1,3-thiazol-2-yl)-1,4-diazepan-1-yl]-2-(2,2,2-trifluoroethoxy)ethanone
CID 86833712

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide?
The IUPAC name of N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide (CID 78892612) is N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide.
What is the SMILES notation for N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide?
The canonical SMILES for N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide is Cc1csc(N(C)C(=O)COCC(F)(F)F)n1.
What is the InChIKey of N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide?
The InChIKey is UXKLWYQUYSGPBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N2O2S/c1-6-4-17-8(13-6)14(2)7(15)3-16-5-9(10,11)12/h4H,3,5H2,1-2H3.
What are the key properties of N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide?
N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide has a molecular weight of 268.26 g/mol, XLogP of 1.99, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide is sourced from PubChem (CID 78892612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).