[4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride

C7H14Cl2N4OS — CID 86811680

IUPAC[4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride
SMILESCl.Cl.NCC1CN(c2nncs2)CCO1
InChIInChI=1S/C7H12N4OS.2ClH/c8-3-6-4-11(1-2-12-6)7-10-9-5-13-7;;/h5-6H,1-4,8H2;2*1H
InChIKeyKFUHOEUHXJEGNP-UHFFFAOYSA-N
MW273.19 g/mol
LogP0.55
Rot. Bonds2

About [4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride

[4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride (PubChem CID 86811680) has the molecular formula C7H14Cl2N4OS and a molecular weight of 273.19 g/mol. Its IUPAC name is [4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride.

Molecular Properties

Compound Name[4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride
PubChem CID86811680
Molecular FormulaC7H14Cl2N4OS
Molecular Weight273.19 g/mol
Exact Mass272.03
IUPAC Name[4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride
SMILESCl.Cl.NCC1CN(c2nncs2)CCO1
InChIInChI=1S/C7H12N4OS.2ClH/c8-3-6-4-11(1-2-12-6)7-10-9-5-13-7;;/h5-6H,1-4,8H2;2*1H
InChIKeyKFUHOEUHXJEGNP-UHFFFAOYSA-N
XLogP0.55
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.19
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[4-(1,3,4-thiadiazol-2-yl)-1,4-oxazepan-2-yl]methanamine
CID 130640806
[4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine
CID 65209424
4-(1,3,4-thiadiazol-2-yl)morpholine;hydrochloride
CID 3047399
N-[[(2S)-4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methyl]quinoxalin-2-amine
CID 100668614
(4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine
CID 61338182
2-[2-(aminomethyl)morpholin-4-yl]pyridine-4-carboxamide
CID 114399474
[4-(4-methylphthalazin-1-yl)morpholin-2-yl]methanamine
CID 61337016
[4-(thiatriazol-5-yl)morpholin-2-yl]methanol
CID 117045194
[4-(6-propylpyridazin-3-yl)morpholin-2-yl]methanamine
CID 116972570
[2-(2-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine
CID 62751187
[4-(2-chlorothieno[3,2-d]pyrimidin-4-yl)morpholin-2-yl]methanamine
CID 59829603
1-phenyl-6-[[(2R)-4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methylamino]-5H-pyrazolo[5,4-d]pyrimidin-4-one
CID 136890813

Frequently Asked Questions

What is the IUPAC name of [4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride?
The IUPAC name of [4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride (CID 86811680) is [4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride.
What is the SMILES notation for [4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride?
The canonical SMILES for [4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride is Cl.Cl.NCC1CN(c2nncs2)CCO1.
What is the InChIKey of [4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride?
The InChIKey is KFUHOEUHXJEGNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4OS.2ClH/c8-3-6-4-11(1-2-12-6)7-10-9-5-13-7;;/h5-6H,1-4,8H2;2*1H.
What are the key properties of [4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride?
[4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride has a molecular weight of 273.19 g/mol, XLogP of 0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1,3,4-thiadiazol-2-yl)morpholin-2-yl]methanamine;dihydrochloride is sourced from PubChem (CID 86811680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).