N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide

C11H15N5OS — CID 92589743

IUPACN-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide
SMILESCCn1nccc1CN(C)C(=O)c1snnc1C
InChIInChI=1S/C11H15N5OS/c1-4-16-9(5-6-12-16)7-15(3)11(17)10-8(2)13-14-18-10/h5-6H,4,7H2,1-3H3
InChIKeyVUVMVZJKWAFQFO-UHFFFAOYSA-N
MW265.34 g/mol
LogP1.34
Rot. Bonds4

About N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide

N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide (PubChem CID 92589743) has the molecular formula C11H15N5OS and a molecular weight of 265.34 g/mol. Its IUPAC name is N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide
PubChem CID92589743
Molecular FormulaC11H15N5OS
Molecular Weight265.34 g/mol
Exact Mass265.10
IUPAC NameN-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide
SMILESCCn1nccc1CN(C)C(=O)c1snnc1C
InChIInChI=1S/C11H15N5OS/c1-4-16-9(5-6-12-16)7-15(3)11(17)10-8(2)13-14-18-10/h5-6H,4,7H2,1-3H3
InChIKeyVUVMVZJKWAFQFO-UHFFFAOYSA-N
XLogP1.34
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide?
The IUPAC name of N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide (CID 92589743) is N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide.
What is the SMILES notation for N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide?
The canonical SMILES for N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide is CCn1nccc1CN(C)C(=O)c1snnc1C.
What is the InChIKey of N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide?
The InChIKey is VUVMVZJKWAFQFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5OS/c1-4-16-9(5-6-12-16)7-15(3)11(17)10-8(2)13-14-18-10/h5-6H,4,7H2,1-3H3.
What are the key properties of N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide?
N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide has a molecular weight of 265.34 g/mol, XLogP of 1.34, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethylpyrazol-3-yl)methyl]-N,4-dimethylthiadiazole-5-carboxamide is sourced from PubChem (CID 92589743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).