4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine

C15H22N4OS — CID 107509600

IUPAC4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine
SMILESCNCc1sc(N(C)CCc2ccccn2)nc1COC
InChIInChI=1S/C15H22N4OS/c1-16-10-14-13(11-20-3)18-15(21-14)19(2)9-7-12-6-4-5-8-17-12/h4-6,8,16H,7,9-11H2,1-3H3
InChIKeyHJHZWBYVFOXKKD-UHFFFAOYSA-N
MW306.44 g/mol
LogP2.08
Rot. Bonds8

About 4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine

4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine (PubChem CID 107509600) has the molecular formula C15H22N4OS and a molecular weight of 306.44 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine
PubChem CID107509600
Molecular FormulaC15H22N4OS
Molecular Weight306.44 g/mol
Exact Mass306.15
IUPAC Name4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine
SMILESCNCc1sc(N(C)CCc2ccccn2)nc1COC
InChIInChI=1S/C15H22N4OS/c1-16-10-14-13(11-20-3)18-15(21-14)19(2)9-7-12-6-4-5-8-17-12/h4-6,8,16H,7,9-11H2,1-3H3
InChIKeyHJHZWBYVFOXKKD-UHFFFAOYSA-N
XLogP2.08
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.44
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-ethyl-N-methyl-5-(methylaminomethyl)-N-(2-phenylethyl)-1,3-thiazol-2-amine
CID 65486953
5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine
CID 62279474
4-(methoxymethyl)-5-(methylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-thiazol-2-amine
CID 107509950
[4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol
CID 107510918
4-(methoxymethyl)-2-[methyl(pyridin-2-ylmethyl)amino]-1,3-thiazole-5-carboxylic acid
CID 107509256
N-methyl-5-pyridin-2-yl-N-(2-pyridin-2-ylethyl)-1,3,4-thiadiazol-2-amine
CID 133466920
N-methyl-N-(2-pyridin-2-ylethyl)-[1,3]thiazolo[4,5-c]pyridin-2-amine
CID 166601640
1-[2-(3-ethyl-2-pyridinyl)-4-(methoxymethyl)-1,3-thiazol-5-yl]-N-methylmethanamine
CID 114365915
2-[4-(methoxymethyl)-5-(methylaminomethyl)-1,3-thiazol-2-yl]-N,N-dimethylethanamine
CID 82441600
1-[4-(methoxymethyl)-2-(phenoxymethyl)-1,3-thiazol-5-yl]-N-methylmethanamine
CID 82440375
[2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol
CID 62752453
N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridazin-3-amine
CID 55055145

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine (CID 107509600) is 4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine is CNCc1sc(N(C)CCc2ccccn2)nc1COC.
What is the InChIKey of 4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine?
The InChIKey is HJHZWBYVFOXKKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4OS/c1-16-10-14-13(11-20-3)18-15(21-14)19(2)9-7-12-6-4-5-8-17-12/h4-6,8,16H,7,9-11H2,1-3H3.
What are the key properties of 4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine?
4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine has a molecular weight of 306.44 g/mol, XLogP of 2.08, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 107509600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).