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

C6H13N5S — CID 62244626

IUPACN-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine
SMILESCCN(C)Cc1nnsc1NN
InChIInChI=1S/C6H13N5S/c1-3-11(2)4-5-6(8-7)12-10-9-5/h8H,3-4,7H2,1-2H3
InChIKeyXFPKWUREOXGCDW-UHFFFAOYSA-N
MW187.27 g/mol
LogP0.28
Rot. Bonds4

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

N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine (PubChem CID 62244626) has the molecular formula C6H13N5S and a molecular weight of 187.27 g/mol. Its IUPAC name is N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine.

Molecular Properties

Compound NameN-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine
PubChem CID62244626
Molecular FormulaC6H13N5S
Molecular Weight187.27 g/mol
Exact Mass187.09
IUPAC NameN-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine
SMILESCCN(C)Cc1nnsc1NN
InChIInChI=1S/C6H13N5S/c1-3-11(2)4-5-6(8-7)12-10-9-5/h8H,3-4,7H2,1-2H3
InChIKeyXFPKWUREOXGCDW-UHFFFAOYSA-N
XLogP0.28
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.27
LogP ≤ 50.28
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

2-[ethyl-[(5-hydrazinylthiadiazol-4-yl)methyl]amino]ethanol
CID 62245305
3-[ethyl-[(5-hydrazinylthiadiazol-4-yl)methyl]amino]propanenitrile
CID 62244391
N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N,1-dimethylpiperidin-4-amine
CID 62245370
4-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylcyclohexan-1-amine
CID 62244219
2-[ethyl-[(5-hydrazinylthiadiazol-4-yl)methyl]amino]-N-methylacetamide
CID 62246445
1-ethyl-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylpiperidin-4-amine
CID 62244769
N-methyl-4-[[methyl(propyl)amino]methyl]thiadiazol-5-amine
CID 62183083
2-[butyl-[(5-hydrazinylthiadiazol-4-yl)methyl]amino]ethanol
CID 62245513
3-[(5-hydrazinylthiadiazol-4-yl)methyl-propan-2-ylamino]propan-1-ol
CID 62245164
1-[[5-(ethylamino)thiadiazol-4-yl]methyl-methylamino]propan-2-ol
CID 62337157
4-(diethylaminomethyl)-N-ethylthiadiazol-5-amine
CID 62178759
N-methyl-4-[[methyl(pentan-3-yl)amino]methyl]thiadiazol-5-amine
CID 62184537

Frequently Asked Questions

What is the IUPAC name of N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine?
The IUPAC name of N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine (CID 62244626) is N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine.
What is the SMILES notation for N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine?
The canonical SMILES for N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine is CCN(C)Cc1nnsc1NN.
What is the InChIKey of N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine?
The InChIKey is XFPKWUREOXGCDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N5S/c1-3-11(2)4-5-6(8-7)12-10-9-5/h8H,3-4,7H2,1-2H3.
What are the key properties of N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine?
N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine has a molecular weight of 187.27 g/mol, XLogP of 0.28, 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-methylethanamine is sourced from PubChem (CID 62244626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).