N-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine

C10H17N3S2 — CID 62766044

IUPACN-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine
SMILESCNCc1sc(N2CCSCC2)nc1C
InChIInChI=1S/C10H17N3S2/c1-8-9(7-11-2)15-10(12-8)13-3-5-14-6-4-13/h11H,3-7H2,1-2H3
InChIKeyHPFAVAZLZGGIRM-UHFFFAOYSA-N
MW243.40 g/mol
LogP1.72
Rot. Bonds3

About N-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine

N-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine (PubChem CID 62766044) has the molecular formula C10H17N3S2 and a molecular weight of 243.40 g/mol. Its IUPAC name is N-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine
PubChem CID62766044
Molecular FormulaC10H17N3S2
Molecular Weight243.40 g/mol
Exact Mass243.09
IUPAC NameN-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine
SMILESCNCc1sc(N2CCSCC2)nc1C
InChIInChI=1S/C10H17N3S2/c1-8-9(7-11-2)15-10(12-8)13-3-5-14-6-4-13/h11H,3-7H2,1-2H3
InChIKeyHPFAVAZLZGGIRM-UHFFFAOYSA-N
XLogP1.72
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.40
LogP ≤ 51.72
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-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine?
The IUPAC name of N-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine (CID 62766044) is N-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine.
What is the SMILES notation for N-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine?
The canonical SMILES for N-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine is CNCc1sc(N2CCSCC2)nc1C.
What is the InChIKey of N-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine?
The InChIKey is HPFAVAZLZGGIRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S2/c1-8-9(7-11-2)15-10(12-8)13-3-5-14-6-4-13/h11H,3-7H2,1-2H3.
What are the key properties of N-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine?
N-methyl-1-(4-methyl-2-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine has a molecular weight of 243.40 g/mol, XLogP of 1.72, 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-thiomorpholin-4-yl-1,3-thiazol-5-yl)methanamine is sourced from PubChem (CID 62766044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).