N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine

C10H14N4S — CID 107977114

IUPACN-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine
SMILESCNC(Cc1cncs1)c1cn(C)cn1
InChIInChI=1S/C10H14N4S/c1-11-9(3-8-4-12-7-15-8)10-5-14(2)6-13-10/h4-7,9,11H,3H2,1-2H3
InChIKeyTWXZCPZKKHAEKZ-UHFFFAOYSA-N
MW222.32 g/mol
LogP1.38
Rot. Bonds4

About N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine

N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine (PubChem CID 107977114) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine
PubChem CID107977114
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC NameN-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine
SMILESCNC(Cc1cncs1)c1cn(C)cn1
InChIInChI=1S/C10H14N4S/c1-11-9(3-8-4-12-7-15-8)10-5-14(2)6-13-10/h4-7,9,11H,3H2,1-2H3
InChIKeyTWXZCPZKKHAEKZ-UHFFFAOYSA-N
XLogP1.38
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(1-methylimidazol-4-yl)-2-thiophen-2-ylethanamine
CID 107974380
N-methyl-1-(1-methylimidazol-4-yl)hexan-1-amine
CID 107974330
N-methyl-1-(1-methylimidazol-4-yl)heptan-1-amine
CID 107974273
1-(4-iodophenyl)-N-methyl-2-(1,3-thiazol-5-yl)ethanamine
CID 105030468
1-(4-fluorophenyl)-N-methyl-2-(1,3-thiazol-5-yl)ethanamine
CID 112642697
N-methyl-2-(1,3-thiazol-5-yl)-1-[4-(trifluoromethyl)phenyl]ethanamine
CID 105030333
1-(4-ethylphenyl)-N-methyl-2-(1,3-thiazol-5-yl)ethanamine
CID 112642771
N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine
CID 112642765
N-methyl-2-(1,3-thiazol-5-yl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 105030553
N-methyl-1-(4-methylthiadiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105177948
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(1-methylimidazol-4-yl)ethanamine
CID 107974435
N-methyl-1-(2-methyl-4-pyridinyl)-2-(1,3-thiazol-5-yl)ethanamine
CID 106755782

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine?
The IUPAC name of N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine (CID 107977114) is N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine.
What is the SMILES notation for N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine?
The canonical SMILES for N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine is CNC(Cc1cncs1)c1cn(C)cn1.
What is the InChIKey of N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine?
The InChIKey is TWXZCPZKKHAEKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-11-9(3-8-4-12-7-15-8)10-5-14(2)6-13-10/h4-7,9,11H,3H2,1-2H3.
What are the key properties of N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine?
N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine has a molecular weight of 222.32 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylimidazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine is sourced from PubChem (CID 107977114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).