4-(diethylaminomethyl)thiadiazol-5-amine

C7H14N4S — CID 62178597

IUPAC4-(diethylaminomethyl)thiadiazol-5-amine
SMILESCCN(CC)Cc1nnsc1N
InChIInChI=1S/C7H14N4S/c1-3-11(4-2)5-6-7(8)12-10-9-6/h3-5,8H2,1-2H3
InChIKeyVTCNFDIHRVBKPW-UHFFFAOYSA-N
MW186.28 g/mol
LogP0.96
Rot. Bonds4

About 4-(diethylaminomethyl)thiadiazol-5-amine

4-(diethylaminomethyl)thiadiazol-5-amine (PubChem CID 62178597) has the molecular formula C7H14N4S and a molecular weight of 186.28 g/mol. Its IUPAC name is 4-(diethylaminomethyl)thiadiazol-5-amine.

Molecular Properties

Compound Name4-(diethylaminomethyl)thiadiazol-5-amine
PubChem CID62178597
Molecular FormulaC7H14N4S
Molecular Weight186.28 g/mol
Exact Mass186.09
IUPAC Name4-(diethylaminomethyl)thiadiazol-5-amine
SMILESCCN(CC)Cc1nnsc1N
InChIInChI=1S/C7H14N4S/c1-3-11(4-2)5-6-7(8)12-10-9-6/h3-5,8H2,1-2H3
InChIKeyVTCNFDIHRVBKPW-UHFFFAOYSA-N
XLogP0.96
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-Amino-N-methyl-1,2,3-thiadiazole-4-carbothioamide
CID 2771457
N-methyl-4-[[propyl(2,2,2-trifluoroethyl)amino]methyl]thiadiazol-5-amine
CID 55046411
4-[[Propyl(2,2,2-trifluoroethyl)amino]methyl]thiadiazol-5-amine
CID 62181921
4-[[Cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]thiadiazol-5-amine
CID 62182446
4-[[Propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]thiadiazol-5-amine
CID 62182803
4-[[Methyl(2,2,2-trifluoroethyl)amino]methyl]thiadiazol-5-amine
CID 62182960
N-methyl-4-[[methyl(2,2,2-trifluoroethyl)amino]methyl]thiadiazol-5-amine
CID 62183486
4-[[Ethyl(2,2,2-trifluoroethyl)amino]methyl]thiadiazol-5-amine
CID 62184033
4-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-N-methylthiadiazol-5-amine
CID 62184386
N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 62245119
N-ethyl-2,2,2-trifluoro-N-[(5-hydrazinylthiadiazol-4-yl)methyl]ethanamine
CID 62245696
2,2,2-trifluoro-N-[(5-hydrazinylthiadiazol-4-yl)methyl]-N-methylethanamine
CID 62246245

Frequently Asked Questions

What is the IUPAC name of 4-(diethylaminomethyl)thiadiazol-5-amine?
The IUPAC name of 4-(diethylaminomethyl)thiadiazol-5-amine (CID 62178597) is 4-(diethylaminomethyl)thiadiazol-5-amine.
What is the SMILES notation for 4-(diethylaminomethyl)thiadiazol-5-amine?
The canonical SMILES for 4-(diethylaminomethyl)thiadiazol-5-amine is CCN(CC)Cc1nnsc1N.
What is the InChIKey of 4-(diethylaminomethyl)thiadiazol-5-amine?
The InChIKey is VTCNFDIHRVBKPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4S/c1-3-11(4-2)5-6-7(8)12-10-9-6/h3-5,8H2,1-2H3.
What are the key properties of 4-(diethylaminomethyl)thiadiazol-5-amine?
4-(diethylaminomethyl)thiadiazol-5-amine has a molecular weight of 186.28 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylaminomethyl)thiadiazol-5-amine is sourced from PubChem (CID 62178597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).