4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride

C6H10ClN3OS — CID 3047399

IUPAC4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride
SMILESCl.c1nnc(N2CCOCC2)s1
InChIInChI=1S/C6H9N3OS.ClH/c1-3-10-4-2-9(1)6-8-7-5-11-6;/h5H,1-4H2;1H
InChIKeyJBJWNKWOUHNUEE-UHFFFAOYSA-N
MW207.69 g/mol
LogP0.80
Rot. Bonds1

About 4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride

4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride (PubChem CID 3047399) has the molecular formula C6H10ClN3OS and a molecular weight of 207.69 g/mol. Its IUPAC name is 4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride.

Molecular Properties

Compound Name4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride
PubChem CID3047399
Molecular FormulaC6H10ClN3OS
Molecular Weight207.69 g/mol
Exact Mass207.02
IUPAC Name4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride
SMILESCl.c1nnc(N2CCOCC2)s1
InChIInChI=1S/C6H9N3OS.ClH/c1-3-10-4-2-9(1)6-8-7-5-11-6;/h5H,1-4H2;1H
InChIKeyJBJWNKWOUHNUEE-UHFFFAOYSA-N
XLogP0.80
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.69
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-methyl-9-(1,3,4-thiadiazol-2-yl)-4-oxa-1,9-diazaspiro[5.5]undecane
CID 97491911
morpholin-4-yl-[(2S)-6-(1,3,4-thiadiazol-2-yl)-6-azaspiro[2.5]octan-2-yl]methanone
CID 97493487
[4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride
CID 86811680
2-(4-propan-2-ylpiperidin-1-yl)-1,3,4-thiadiazole
CID 169304025
morpholin-4-yl-[6-(1,3,4-thiadiazol-2-yl)-6-azaspiro[2.5]octan-2-yl]methanone;2,2,2-trifluoroacetic acid
CID 155840662
N,4-dimethyl-1-(1,3,4-thiadiazol-2-yl)piperidin-4-amine
CID 115305535
[4-(1,3,4-thiadiazol-2-yl)-1,4-oxazepan-2-yl]methanamine
CID 130640806
(2-morpholin-4-yl-1,3-thiazol-4-yl)boronic acid
CID 66632378
(6R)-2-(furan-3-ylmethyl)-11-(1,3,4-thiadiazol-2-yl)-8-oxa-2,11-diazaspiro[5.6]dodecane
CID 97372941
4-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]morpholine;hydrochloride
CID 72720133
4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine
CID 58663759
4-(3-bromo-1,2,4-thiadiazol-5-yl)morpholine
CID 66634232

Frequently Asked Questions

What is the IUPAC name of 4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride?
The IUPAC name of 4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride (CID 3047399) is 4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride.
What is the SMILES notation for 4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride?
The canonical SMILES for 4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride is Cl.c1nnc(N2CCOCC2)s1.
What is the InChIKey of 4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride?
The InChIKey is JBJWNKWOUHNUEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3OS.ClH/c1-3-10-4-2-9(1)6-8-7-5-11-6;/h5H,1-4H2;1H.
What are the key properties of 4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride?
4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride has a molecular weight of 207.69 g/mol, XLogP of 0.80, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride is sourced from PubChem (CID 3047399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).