N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide

C11H18N2OS — CID 20655939

IUPACN,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide
SMILESCc1csc(C(C)N(C)C(=O)C(C)C)n1
InChIInChI=1S/C11H18N2OS/c1-7(2)11(14)13(5)9(4)10-12-8(3)6-15-10/h6-7,9H,1-5H3
InChIKeyYOJDRJHQZOLBQV-UHFFFAOYSA-N
MW226.34 g/mol
LogP2.63
Rot. Bonds3

About N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide

N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide (PubChem CID 20655939) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide.

Molecular Properties

Compound NameN,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide
PubChem CID20655939
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC NameN,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide
SMILESCc1csc(C(C)N(C)C(=O)C(C)C)n1
InChIInChI=1S/C11H18N2OS/c1-7(2)11(14)13(5)9(4)10-12-8(3)6-15-10/h6-7,9H,1-5H3
InChIKeyYOJDRJHQZOLBQV-UHFFFAOYSA-N
XLogP2.63
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]acetamide
CID 143571852
2-[acetyl(methyl)amino]-2-(4-methyl-1,3-thiazol-2-yl)acetic acid
CID 104770718
1-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-1-methyl-3-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]urea
CID 71878365
1,1-diethyl-3-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]urea
CID 115609023
3-benzhydryl-N-methyl-N-[(1R)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]-1,2-oxazole-5-carboxamide
CID 26353558
2-methyl-3-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]-3-oxopropanoic acid
CID 114898569
N,3-dimethyl-N-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]-4-oxoquinazoline-7-carboxamide
CID 99930856
N,3-dimethyl-N-[(1R)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]-4-oxoquinazoline-7-carboxamide
CID 99930855
2-amino-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide;dihydrochloride
CID 119875872
N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-2-[5-(pyrrolidin-1-ylmethyl)tetrazol-1-yl]acetamide
CID 45212940
3-bromo-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide
CID 82108654
(2R)-2-[1-(4-methyl-1,3-thiazol-2-yl)ethylcarbamoylamino]propanoic acid
CID 78995805

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide?
The IUPAC name of N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide (CID 20655939) is N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide.
What is the SMILES notation for N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide?
The canonical SMILES for N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide is Cc1csc(C(C)N(C)C(=O)C(C)C)n1.
What is the InChIKey of N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide?
The InChIKey is YOJDRJHQZOLBQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-7(2)11(14)13(5)9(4)10-12-8(3)6-15-10/h6-7,9H,1-5H3.
What are the key properties of N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide?
N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide has a molecular weight of 226.34 g/mol, XLogP of 2.63, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide is sourced from PubChem (CID 20655939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).