N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride

C8H14ClN3O2S — CID 119744727

IUPACN-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)Nc1nc(COC)cs1.Cl
InChIInChI=1S/C8H13N3O2S.ClH/c1-9-3-7(12)11-8-10-6(4-13-2)5-14-8;/h5,9H,3-4H2,1-2H3,(H,10,11,12);1H
InChIKeyRGWHKXCKQCLNEZ-UHFFFAOYSA-N
MW251.74 g/mol
LogP0.87
Rot. Bonds5

About N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride

N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride (PubChem CID 119744727) has the molecular formula C8H14ClN3O2S and a molecular weight of 251.74 g/mol. Its IUPAC name is N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride
PubChem CID119744727
Molecular FormulaC8H14ClN3O2S
Molecular Weight251.74 g/mol
Exact Mass251.05
IUPAC NameN-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)Nc1nc(COC)cs1.Cl
InChIInChI=1S/C8H13N3O2S.ClH/c1-9-3-7(12)11-8-10-6(4-13-2)5-14-8;/h5,9H,3-4H2,1-2H3,(H,10,11,12);1H
InChIKeyRGWHKXCKQCLNEZ-UHFFFAOYSA-N
XLogP0.87
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.74
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(methoxymethyl)-1,3-thiazol-2-yl]carbamic acid
CID 87285914
1-[4-(methoxymethyl)-1,3-thiazol-2-yl]-3-thiophen-3-ylurea
CID 99833695
methyl 2-[2-(3-methoxypropanoylamino)-1,3-thiazol-4-yl]acetate
CID 62589885
N-[4-(methoxymethyl)-1,3-thiazol-2-yl]pyrrolidine-2-carboxamide
CID 119301038
N-[4-(5-methoxy-2-pyridinyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide
CID 146214695
1-[4-(methoxymethyl)-1,3-thiazol-2-yl]-3-(pyridin-2-ylmethyl)urea
CID 75464257
2-[4-(methoxymethyl)-1,3-thiazol-2-yl]-1,1-dimethylhydrazine
CID 131059203
N-[4-(chloromethyl)-1,3-thiazol-2-yl]-2-(2-methoxyethoxy)acetamide
CID 108745935
N-(4-ethyl-1,3-thiazol-2-yl)butanamide
CID 87065374
N-[4-(chloromethyl)-1,3-thiazol-2-yl]propanamide
CID 10398016
methyl N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]carbamate
CID 47299980
methyl 2-[2-[[2-(4-hydroxyphenyl)acetyl]amino]-1,3-thiazol-4-yl]acetate
CID 43623058

Frequently Asked Questions

What is the IUPAC name of N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride?
The IUPAC name of N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride (CID 119744727) is N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride.
What is the SMILES notation for N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride?
The canonical SMILES for N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride is CNCC(=O)Nc1nc(COC)cs1.Cl.
What is the InChIKey of N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride?
The InChIKey is RGWHKXCKQCLNEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2S.ClH/c1-9-3-7(12)11-8-10-6(4-13-2)5-14-8;/h5,9H,3-4H2,1-2H3,(H,10,11,12);1H.
What are the key properties of N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride?
N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride has a molecular weight of 251.74 g/mol, XLogP of 0.87, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methoxymethyl)-1,3-thiazol-2-yl]-2-(methylamino)acetamide;hydrochloride is sourced from PubChem (CID 119744727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).