1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine

C7H9N5S — CID 60809159

IUPAC1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine
SMILESCn1ccc(NCc2csnn2)n1
InChIInChI=1S/C7H9N5S/c1-12-3-2-7(10-12)8-4-6-5-13-11-9-6/h2-3,5H,4H2,1H3,(H,8,10)
InChIKeyIJXKHMNRPUBKJS-UHFFFAOYSA-N
MW195.25 g/mol
LogP0.88
Rot. Bonds3

About 1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine

1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine (PubChem CID 60809159) has the molecular formula C7H9N5S and a molecular weight of 195.25 g/mol. Its IUPAC name is 1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine
PubChem CID60809159
Molecular FormulaC7H9N5S
Molecular Weight195.25 g/mol
Exact Mass195.06
IUPAC Name1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine
SMILESCn1ccc(NCc2csnn2)n1
InChIInChI=1S/C7H9N5S/c1-12-3-2-7(10-12)8-4-6-5-13-11-9-6/h2-3,5H,4H2,1H3,(H,8,10)
InChIKeyIJXKHMNRPUBKJS-UHFFFAOYSA-N
XLogP0.88
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.25
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine
CID 130599823
6-[[(1-methylpyrazol-3-yl)amino]methyl]pyridin-3-amine
CID 103568651
1-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrazol-3-amine
CID 131181946
4-(methylsulfanylmethyl)-N-(thiadiazol-4-ylmethyl)pyridin-2-amine
CID 115908368
N-[(4-iodophenyl)methyl]-1-methylpyrazol-3-amine
CID 79778850
1-methyl-N-[[2,4,6-trimethyl-3-[[(1-methylpyrazol-3-yl)amino]methyl]-5-[[2,4,6-trimethyl-3,5-bis[[(1-methylpyrazol-3-yl)amino]methyl]phenyl]methyl]phenyl]methyl]pyrazol-3-amine
CID 122206251
1-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyrazol-3-amine
CID 66400028
5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine
CID 115908362
N-[(5-bromothiophen-2-yl)methyl]-1-methylpyrazol-3-amine
CID 60808995
N-[(5-fluorothiophen-2-yl)methyl]-1-methylpyrazol-3-amine;hydrochloride
CID 126964997
N-[(2-ethylphenyl)methyl]-1-methylpyrazol-3-amine
CID 62392134
6-[[(1-methylpyrazol-3-yl)amino]methyl]pyridine-2-carboxylic acid
CID 106904796

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine?
The IUPAC name of 1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine (CID 60809159) is 1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine.
What is the SMILES notation for 1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine?
The canonical SMILES for 1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine is Cn1ccc(NCc2csnn2)n1.
What is the InChIKey of 1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine?
The InChIKey is IJXKHMNRPUBKJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5S/c1-12-3-2-7(10-12)8-4-6-5-13-11-9-6/h2-3,5H,4H2,1H3,(H,8,10).
What are the key properties of 1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine?
1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine has a molecular weight of 195.25 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine is sourced from PubChem (CID 60809159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).