1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine

C8H11N5S — CID 130599823

IUPAC1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine
SMILESCc1nnsc1CNc1ccn(C)n1
InChIInChI=1S/C8H11N5S/c1-6-7(14-12-10-6)5-9-8-3-4-13(2)11-8/h3-4H,5H2,1-2H3,(H,9,11)
InChIKeyILBDLECLTWMTJX-UHFFFAOYSA-N
MW209.28 g/mol
LogP1.19
Rot. Bonds3

About 1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine

1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine (PubChem CID 130599823) has the molecular formula C8H11N5S and a molecular weight of 209.28 g/mol. Its IUPAC name is 1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine.

Molecular Properties

Compound Name1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine
PubChem CID130599823
Molecular FormulaC8H11N5S
Molecular Weight209.28 g/mol
Exact Mass209.07
IUPAC Name1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine
SMILESCc1nnsc1CNc1ccn(C)n1
InChIInChI=1S/C8H11N5S/c1-6-7(14-12-10-6)5-9-8-3-4-13(2)11-8/h3-4H,5H2,1-2H3,(H,9,11)
InChIKeyILBDLECLTWMTJX-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

N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-methylpyrazol-3-amine;hydrochloride
CID 126963985
1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine
CID 60809159
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-butan-2-yl-5-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine
CID 138057350
N-[(5-fluorothiophen-2-yl)methyl]-1-methylpyrazol-3-amine;hydrochloride
CID 126964997
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-methylpyrazol-3-amine
CID 79778271
N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-1-methylpyrazol-3-amine
CID 71971585
N-[(4-iodophenyl)methyl]-1-methylpyrazol-3-amine
CID 79778850
1-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyrazol-3-amine
CID 66400028
N-[(5-bromothiophen-2-yl)methyl]-1-methylpyrazol-3-amine
CID 60808995
N-[[4-(1-aminoethenyl)-2-tert-butyl-1,3-thiazol-5-yl]methyl]-1-methylpyrazol-3-amine
CID 170575078
3-methyl-5-[[(1-methylpyrazol-3-yl)amino]methyl]furan-2-carboxylic acid
CID 103256805

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine?
The IUPAC name of 1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine (CID 130599823) is 1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine.
What is the SMILES notation for 1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine?
The canonical SMILES for 1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine is Cc1nnsc1CNc1ccn(C)n1.
What is the InChIKey of 1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine?
The InChIKey is ILBDLECLTWMTJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5S/c1-6-7(14-12-10-6)5-9-8-3-4-13(2)11-8/h3-4H,5H2,1-2H3,(H,9,11).
What are the key properties of 1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine?
1-methyl-N-[(4-methylthiadiazol-5-yl)methyl]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-methyl-N-[(4-methylthiadiazol-5-yl)methyl]pyrazol-3-amine is sourced from PubChem (CID 130599823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).