N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline

C10H13N5S — CID 62245937

IUPACN-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline
SMILESCN(Cc1nnsc1NN)c1ccccc1
InChIInChI=1S/C10H13N5S/c1-15(8-5-3-2-4-6-8)7-9-10(12-11)16-14-13-9/h2-6,12H,7,11H2,1H3
InChIKeyVCXKBBWSRSDGCN-UHFFFAOYSA-N
MW235.32 g/mol
LogP1.46
Rot. Bonds4

About N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline

N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline (PubChem CID 62245937) has the molecular formula C10H13N5S and a molecular weight of 235.32 g/mol. Its IUPAC name is N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline.

Molecular Properties

Compound NameN-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline
PubChem CID62245937
Molecular FormulaC10H13N5S
Molecular Weight235.32 g/mol
Exact Mass235.09
IUPAC NameN-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline
SMILESCN(Cc1nnsc1NN)c1ccccc1
InChIInChI=1S/C10H13N5S/c1-15(8-5-3-2-4-6-8)7-9-10(12-11)16-14-13-9/h2-6,12H,7,11H2,1H3
InChIKeyVCXKBBWSRSDGCN-UHFFFAOYSA-N
XLogP1.46
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.32
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-Anilino-1,2,3-thiadiazole-4-carbothioamide
CID 14028174
4-(aminomethyl)-N-phenylthiadiazol-5-amine
CID 12051746
N'-methyl-N'-phenyl-N-(thiadiazol-4-ylmethyl)propane-1,3-diamine
CID 43663847
5-Anilino-4-methyl-1,2,3-thiadiazol
CID 555560
1-(5-Phenylamino-1,2,3-thiadiazol-4-yl)ethane-thione
CID 129743507
4-[(N-ethyl-4-fluoroanilino)methyl]-N-methylthiadiazol-5-amine
CID 55046224
4-[(3-fluoro-N-methylanilino)methyl]-N-methylthiadiazol-5-amine
CID 55046421
4-[(4-fluoro-N-methylanilino)methyl]-N-propylthiadiazol-5-amine
CID 55046754
4-[(2-fluoro-N-methylanilino)methyl]-N-methylthiadiazol-5-amine
CID 55046756
4-[[4-(2-Fluorophenyl)piperazin-1-yl]methyl]thiadiazol-5-amine
CID 62177324
4-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-N-methylthiadiazol-5-amine
CID 62177498
4-[(4-fluoro-N-methylanilino)methyl]thiadiazol-5-amine
CID 62182313

Frequently Asked Questions

What is the IUPAC name of N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline?
The IUPAC name of N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline (CID 62245937) is N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline.
What is the SMILES notation for N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline?
The canonical SMILES for N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline is CN(Cc1nnsc1NN)c1ccccc1.
What is the InChIKey of N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline?
The InChIKey is VCXKBBWSRSDGCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5S/c1-15(8-5-3-2-4-6-8)7-9-10(12-11)16-14-13-9/h2-6,12H,7,11H2,1H3.
What are the key properties of N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline?
N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline has a molecular weight of 235.32 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylaniline is sourced from PubChem (CID 62245937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).