5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride

C11H16ClN5S — CID 120904268

IUPAC5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride
SMILESCN(CCc1cnccn1)Cc1cnc(N)s1.Cl
InChIInChI=1S/C11H15N5S.ClH/c1-16(8-10-7-15-11(12)17-10)5-2-9-6-13-3-4-14-9;/h3-4,6-7H,2,5,8H2,1H3,(H2,12,15);1H
InChIKeyVOUPFGAZRBJVFJ-UHFFFAOYSA-N
MW285.80 g/mol
LogP1.61
Rot. Bonds5

About 5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride

5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride (PubChem CID 120904268) has the molecular formula C11H16ClN5S and a molecular weight of 285.80 g/mol. Its IUPAC name is 5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride.

Molecular Properties

Compound Name5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride
PubChem CID120904268
Molecular FormulaC11H16ClN5S
Molecular Weight285.80 g/mol
Exact Mass285.08
IUPAC Name5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride
SMILESCN(CCc1cnccn1)Cc1cnc(N)s1.Cl
InChIInChI=1S/C11H15N5S.ClH/c1-16(8-10-7-15-11(12)17-10)5-2-9-6-13-3-4-14-9;/h3-4,6-7H,2,5,8H2,1H3,(H2,12,15);1H
InChIKeyVOUPFGAZRBJVFJ-UHFFFAOYSA-N
XLogP1.61
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.80
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120902294
5-[[2-methoxyethyl(methyl)amino]methyl]-1,3-thiazol-2-amine
CID 79771856
N-[(2-amino-1,3-thiazol-5-yl)methyl]-N-methyl-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 120902202
5-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-1,3-thiazol-2-amine
CID 79771928
5-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120900861
5-[[methyl-[2-(oxan-4-yl)ethyl]amino]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120900881
5-[[methyl-[2-(3-nitrophenyl)ethyl]amino]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120905813
5-[[(4-fluorophenyl)methyl-methylamino]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120897486
5-[[(3,5-difluorophenyl)methyl-methylamino]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120903914
1-methyl-1-(pyrazin-2-ylmethyl)hydrazine
CID 169495103
2-[[(2-amino-1,3-thiazol-5-yl)methyl-methylamino]methyl]-2-methylpropane-1,3-diol;hydrochloride
CID 120900718
5-[[2-(2-chlorophenoxy)ethyl-methylamino]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120897808

Frequently Asked Questions

What is the IUPAC name of 5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride?
The IUPAC name of 5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride (CID 120904268) is 5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride.
What is the SMILES notation for 5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride?
The canonical SMILES for 5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride is CN(CCc1cnccn1)Cc1cnc(N)s1.Cl.
What is the InChIKey of 5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride?
The InChIKey is VOUPFGAZRBJVFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5S.ClH/c1-16(8-10-7-15-11(12)17-10)5-2-9-6-13-3-4-14-9;/h3-4,6-7H,2,5,8H2,1H3,(H2,12,15);1H.
What are the key properties of 5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride?
5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride has a molecular weight of 285.80 g/mol, XLogP of 1.61, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[methyl(2-pyrazin-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride is sourced from PubChem (CID 120904268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).