N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine

C11H19N3OS — CID 62765189

IUPACN-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine
SMILESCNCc1sc(N2CCOC(C)C2)nc1C
InChIInChI=1S/C11H19N3OS/c1-8-7-14(4-5-15-8)11-13-9(2)10(16-11)6-12-3/h8,12H,4-7H2,1-3H3
InChIKeyPNZFYXLSSIDSAR-UHFFFAOYSA-N
MW241.36 g/mol
LogP1.40
Rot. Bonds3

About N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine

N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine (PubChem CID 62765189) has the molecular formula C11H19N3OS and a molecular weight of 241.36 g/mol. Its IUPAC name is N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine
PubChem CID62765189
Molecular FormulaC11H19N3OS
Molecular Weight241.36 g/mol
Exact Mass241.12
IUPAC NameN-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine
SMILESCNCc1sc(N2CCOC(C)C2)nc1C
InChIInChI=1S/C11H19N3OS/c1-8-7-14(4-5-15-8)11-13-9(2)10(16-11)6-12-3/h8,12H,4-7H2,1-3H3
InChIKeyPNZFYXLSSIDSAR-UHFFFAOYSA-N
XLogP1.40
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine?
The IUPAC name of N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine (CID 62765189) is N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine.
What is the SMILES notation for N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine?
The canonical SMILES for N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine is CNCc1sc(N2CCOC(C)C2)nc1C.
What is the InChIKey of N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine?
The InChIKey is PNZFYXLSSIDSAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3OS/c1-8-7-14(4-5-15-8)11-13-9(2)10(16-11)6-12-3/h8,12H,4-7H2,1-3H3.
What are the key properties of N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine?
N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine has a molecular weight of 241.36 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[4-methyl-2-(2-methylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine is sourced from PubChem (CID 62765189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).