1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine

C8H11N5S — CID 130961358

IUPAC1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine
SMILESCc1cc(NCc2cnsn2)nn1C
InChIInChI=1S/C8H11N5S/c1-6-3-8(11-13(6)2)9-4-7-5-10-14-12-7/h3,5H,4H2,1-2H3,(H,9,11)
InChIKeyIVPBYGVCFTWZEM-UHFFFAOYSA-N
MW209.28 g/mol
LogP1.19
Rot. Bonds3

About 1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine

1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine (PubChem CID 130961358) has the molecular formula C8H11N5S and a molecular weight of 209.28 g/mol. Its IUPAC name is 1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine.

Molecular Properties

Compound Name1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine
PubChem CID130961358
Molecular FormulaC8H11N5S
Molecular Weight209.28 g/mol
Exact Mass209.07
IUPAC Name1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine
SMILESCc1cc(NCc2cnsn2)nn1C
InChIInChI=1S/C8H11N5S/c1-6-3-8(11-13(6)2)9-4-7-5-10-14-12-7/h3,5H,4H2,1-2H3,(H,9,11)
InChIKeyIVPBYGVCFTWZEM-UHFFFAOYSA-N
XLogP1.19
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.28
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1,5-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazol-3-amine
CID 19626325
N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine
CID 122166863
N-[(2,6-dimethylphenyl)methyl]-1,5-dimethylpyrazol-3-amine
CID 113349771
N-[(2,5-dimethylfuran-3-yl)methyl]-1,5-dimethylpyrazol-3-amine
CID 115876966
N-[(3-amino-4-chlorophenyl)methyl]-1,5-dimethylpyrazol-3-amine
CID 114253659
N-[(2-bromophenyl)methyl]-1,5-dimethylpyrazol-3-amine
CID 115751708
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,5-dimethylpyrazol-3-amine
CID 115751678
1,5-dimethyl-N-[(2-propan-2-ylpyrazol-3-yl)methyl]pyrazol-3-amine;hydrochloride
CID 126967946
4-[[(1,5-dimethylpyrazol-3-yl)amino]methyl]benzene-1,3-diol
CID 19627587
2-[[(1,5-dimethylpyrazol-3-yl)amino]methyl]-4-methylphenol
CID 113290187
N-[(3-fluoro-4-methoxyphenyl)methyl]-1,5-dimethylpyrazol-3-amine
CID 113290173
N-(1,3-benzothiazol-2-ylmethyl)-1,5-dimethylpyrazol-3-amine
CID 114253553

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine?
The IUPAC name of 1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine (CID 130961358) is 1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine.
What is the SMILES notation for 1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine?
The canonical SMILES for 1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine is Cc1cc(NCc2cnsn2)nn1C.
What is the InChIKey of 1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine?
The InChIKey is IVPBYGVCFTWZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5S/c1-6-3-8(11-13(6)2)9-4-7-5-10-14-12-7/h3,5H,4H2,1-2H3,(H,9,11).
What are the key properties of 1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine?
1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine has a molecular weight of 209.28 g/mol, XLogP of 1.19, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-(1,2,5-thiadiazol-3-ylmethyl)pyrazol-3-amine is sourced from PubChem (CID 130961358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).