5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride

C11H20ClN3OS — CID 120899233

IUPAC5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride
SMILESCCC1CN(Cc2cnc(N)s2)CC(C)O1.Cl
InChIInChI=1S/C11H19N3OS.ClH/c1-3-9-6-14(5-8(2)15-9)7-10-4-13-11(12)16-10;/h4,8-9H,3,5-7H2,1-2H3,(H2,12,13);1H
InChIKeyCCMBDSYXDCGRDX-UHFFFAOYSA-N
MW277.82 g/mol
LogP2.15
Rot. Bonds3

About 5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride

5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride (PubChem CID 120899233) has the molecular formula C11H20ClN3OS and a molecular weight of 277.82 g/mol. Its IUPAC name is 5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride.

Molecular Properties

Compound Name5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride
PubChem CID120899233
Molecular FormulaC11H20ClN3OS
Molecular Weight277.82 g/mol
Exact Mass277.10
IUPAC Name5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride
SMILESCCC1CN(Cc2cnc(N)s2)CC(C)O1.Cl
InChIInChI=1S/C11H19N3OS.ClH/c1-3-9-6-14(5-8(2)15-9)7-10-4-13-11(12)16-10;/h4,8-9H,3,5-7H2,1-2H3,(H2,12,13);1H
InChIKeyCCMBDSYXDCGRDX-UHFFFAOYSA-N
XLogP2.15
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.82
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride?
The IUPAC name of 5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride (CID 120899233) is 5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride.
What is the SMILES notation for 5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride?
The canonical SMILES for 5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride is CCC1CN(Cc2cnc(N)s2)CC(C)O1.Cl.
What is the InChIKey of 5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride?
The InChIKey is CCMBDSYXDCGRDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3OS.ClH/c1-3-9-6-14(5-8(2)15-9)7-10-4-13-11(12)16-10;/h4,8-9H,3,5-7H2,1-2H3,(H2,12,13);1H.
What are the key properties of 5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride?
5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride has a molecular weight of 277.82 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-ethyl-6-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-amine;hydrochloride is sourced from PubChem (CID 120899233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).