3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide

C11H14N4O2S — CID 164879819

IUPAC3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide
SMILESCOCc1cc(C(=O)Nc2ncc(C)s2)n(C)n1
InChIInChI=1S/C11H14N4O2S/c1-7-5-12-11(18-7)13-10(16)9-4-8(6-17-3)14-15(9)2/h4-5H,6H2,1-3H3,(H,12,13,16)
InChIKeyLXLJXWVDJJIJEW-UHFFFAOYSA-N
MW266.33 g/mol
LogP1.58
Rot. Bonds4

About 3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide

3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide (PubChem CID 164879819) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is 3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide
PubChem CID164879819
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC Name3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide
SMILESCOCc1cc(C(=O)Nc2ncc(C)s2)n(C)n1
InChIInChI=1S/C11H14N4O2S/c1-7-5-12-11(18-7)13-10(16)9-4-8(6-17-3)14-15(9)2/h4-5H,6H2,1-3H3,(H,12,13,16)
InChIKeyLXLJXWVDJJIJEW-UHFFFAOYSA-N
XLogP1.58
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 2-(1,5-dimethyl-1H-pyrazole-3-carboxamido)thiazole-4-carboxylate
CID 16952133
1,5-dimethyl-N-(thiazol-2-yl)-1H-pyrazole-3-carboxamide
CID 16952207
ethyl 2-(1,3-dimethyl-1H-pyrazole-5-carboxamido)thiazole-4-carboxylate
CID 16952741
2-[[(2S)-2-[[6-oxo-5-(trifluoromethyl)-1H-pyridazin-4-yl]amino]propoxy]methyl]-5-[5-(trifluoromethyl)-1,3-thiazol-2-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 166132367
ethyl 1-methyl-3-{[(5-methyl-1,3-thiazol-2-yl)amino]carbonyl}-1H-pyrazole-5-carboxylate
CID 24056935
Ethyl 5-methyl-1-(1,3-thiazol-2-yl)pyrazole-3-carboxylate
CID 134397345
Ethyl 5-methyl-2-(1,3-thiazol-2-yl)pyrazole-3-carboxylate
CID 134397398
[3-[2-[[3-(methoxymethyl)-1-methylpyrazole-5-carbonyl]amino]-1,3-thiazol-5-yl]cyclobutyl]methyl N-propan-2-ylcarbamate
CID 164879470
[(3S,5S)-5-[2-[[3-(methoxymethyl)-1-methylpyrazole-5-carbonyl]amino]-1,3-thiazol-5-yl]oxolan-3-yl] N-(1-methylcyclopropyl)carbamate
CID 164879609
[(3R,5R)-5-[2-[[3-(methoxymethyl)-1-methylpyrazole-5-carbonyl]amino]-1,3-thiazol-5-yl]oxolan-3-yl] N-(1-methylcyclopropyl)carbamate
CID 164879914
[5-[2-[[3-(methoxymethyl)-1-methylpyrazole-5-carbonyl]amino]-1,3-thiazol-5-yl]oxolan-3-yl]sulfanyl N-(1-methylcyclopropyl)carbamate
CID 164879920
3-(methoxymethyl)-1-methyl-N-[5-[(2R)-oxolan-2-yl]-1,3-thiazol-2-yl]pyrazole-5-carboxamide
CID 174157769

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide?
The IUPAC name of 3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide (CID 164879819) is 3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide.
What is the SMILES notation for 3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide?
The canonical SMILES for 3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide is COCc1cc(C(=O)Nc2ncc(C)s2)n(C)n1.
What is the InChIKey of 3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide?
The InChIKey is LXLJXWVDJJIJEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c1-7-5-12-11(18-7)13-10(16)9-4-8(6-17-3)14-15(9)2/h4-5H,6H2,1-3H3,(H,12,13,16).
What are the key properties of 3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide?
3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide has a molecular weight of 266.33 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxamide is sourced from PubChem (CID 164879819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).