N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride

C5H10ClN3S — CID 3047401

IUPACN,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride
SMILESCc1nnc(N(C)C)s1.Cl
InChIInChI=1S/C5H9N3S.ClH/c1-4-6-7-5(9-4)8(2)3;/h1-3H3;1H
InChIKeyLYGTYHLGPUCTIM-UHFFFAOYSA-N
MW179.68 g/mol
LogP1.33
Rot. Bonds1

About N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride

N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride (PubChem CID 3047401) has the molecular formula C5H10ClN3S and a molecular weight of 179.68 g/mol. Its IUPAC name is N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride.

Molecular Properties

Compound NameN,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride
PubChem CID3047401
Molecular FormulaC5H10ClN3S
Molecular Weight179.68 g/mol
Exact Mass179.03
IUPAC NameN,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride
SMILESCc1nnc(N(C)C)s1.Cl
InChIInChI=1S/C5H9N3S.ClH/c1-4-6-7-5(9-4)8(2)3;/h1-3H3;1H
InChIKeyLYGTYHLGPUCTIM-UHFFFAOYSA-N
XLogP1.33
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.68
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N,5-trimethyl-1,3,4-thiadiazol-2-amine
CID 3047402
N,N-dimethyl-5-(trichloromethyl)-1,3,4-thiadiazol-2-amine
CID 12639710
N-fluoro-N,5-dimethyl-1,3,4-thiadiazol-2-amine
CID 178103613
N,N-dimethyl-N'-(5-methyl-1,3,4-thiadiazol-2-yl)methanimidamide
CID 9583082
N,N,4,5-tetramethyl-1,3,4-thiadiazol-4-ium-2-amine
CID 22960008
5-butyl-N,N-dimethyl-1,3,4-thiadiazol-2-amine
CID 23383491
N,N-diethyl-5-methyl-1,3,4-thiadiazol-2-amine
CID 58113301
N-(2-isocyanoethyl)-N,5-dimethyl-1,3,4-thiadiazol-2-amine
CID 59034813
N,5-dimethyl-N-propyl-1,3,4-thiadiazol-2-amine
CID 130743882
N-butyl-N,5-dimethyl-1,3,4-thiadiazol-2-amine
CID 142857318
N-tert-butyl-N,5-dimethyl-1,3,4-thiadiazol-2-amine
CID 172486263
N,5-dimethyl-1,3,4-thiadiazol-2-amine;hydrochloride
CID 175212002

Frequently Asked Questions

What is the IUPAC name of N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride?
The IUPAC name of N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride (CID 3047401) is N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride.
What is the SMILES notation for N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride?
The canonical SMILES for N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride is Cc1nnc(N(C)C)s1.Cl.
What is the InChIKey of N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride?
The InChIKey is LYGTYHLGPUCTIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3S.ClH/c1-4-6-7-5(9-4)8(2)3;/h1-3H3;1H.
What are the key properties of N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride?
N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride has a molecular weight of 179.68 g/mol, XLogP of 1.33, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,5-trimethyl-1,3,4-thiadiazol-2-amine;hydrochloride is sourced from PubChem (CID 3047401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).