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

C10H16N2OS — CID 131067153

IUPACN-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine
SMILESCNC(c1cc(C)ns1)C1CCCO1
InChIInChI=1S/C10H16N2OS/c1-7-6-9(14-12-7)10(11-2)8-4-3-5-13-8/h6,8,10-11H,3-5H2,1-2H3
InChIKeyVDMJNLDIIRKQOQ-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.89
Rot. Bonds3

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

N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine (PubChem CID 131067153) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine
PubChem CID131067153
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC NameN-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine
SMILESCNC(c1cc(C)ns1)C1CCCO1
InChIInChI=1S/C10H16N2OS/c1-7-6-9(14-12-7)10(11-2)8-4-3-5-13-8/h6,8,10-11H,3-5H2,1-2H3
InChIKeyVDMJNLDIIRKQOQ-UHFFFAOYSA-N
XLogP1.89
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-Methyl-1,2-thiazol-5-yl)piperidin-3-ol
CID 112488163
2-(3-Methyl-1,2-thiazol-5-yl)pyrrolidin-3-ol
CID 112489053
(3-Methyl-1,2-thiazol-5-yl)-(oxolan-2-yl)methanamine
CID 126985716
Oxolan-2-yl(1,2-thiazol-3-yl)methanamine
CID 126985781
2-methyl-N-[(3-methyl-1,2-thiazol-5-yl)methyl]oxolan-3-amine
CID 126986975
2-(5-Methyl-1,2-thiazol-3-yl)pyrrolidin-3-ol
CID 129977186
N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine
CID 130642110
(5-Methyloxolan-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanamine
CID 130642281
1,4-Dioxan-2-yl-(3-methyl-1,2-thiazol-5-yl)methanamine
CID 130653733
(3-Methyloxolan-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanamine
CID 130662906
(3-Methyl-1,2-thiazol-5-yl)-(oxan-2-yl)methanamine
CID 130673408
(5-Methyloxolan-2-yl)-(1,2-thiazol-3-yl)methanamine
CID 130678046

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine?
The IUPAC name of N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine (CID 131067153) is N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine is CNC(c1cc(C)ns1)C1CCCO1.
What is the InChIKey of N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine?
The InChIKey is VDMJNLDIIRKQOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-7-6-9(14-12-7)10(11-2)8-4-3-5-13-8/h6,8,10-11H,3-5H2,1-2H3.
What are the key properties of N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine?
N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine has a molecular weight of 212.32 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine is sourced from PubChem (CID 131067153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).