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

C9H14N2OS — CID 164646028

IUPACN-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine
SMILESCNC1COC(c2cc(C)ns2)C1
InChIInChI=1S/C9H14N2OS/c1-6-3-9(13-11-6)8-4-7(10-2)5-12-8/h3,7-8,10H,4-5H2,1-2H3
InChIKeyPKRCERFVXPXWBY-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.50
Rot. Bonds2

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

N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine (PubChem CID 164646028) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine.

Molecular Properties

Compound NameN-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine
PubChem CID164646028
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC NameN-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine
SMILESCNC1COC(c2cc(C)ns2)C1
InChIInChI=1S/C9H14N2OS/c1-6-3-9(13-11-6)8-4-7(10-2)5-12-8/h3,7-8,10H,4-5H2,1-2H3
InChIKeyPKRCERFVXPXWBY-UHFFFAOYSA-N
XLogP1.50
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-(Methoxymethyl)-1,2-thiazol-5-yl]propan-1-amine
CID 82405705
(3-Methyl-1,2-thiazol-5-yl)-(oxolan-2-yl)methanamine
CID 126985716
(5-Methyloxolan-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanamine
CID 130642281
(3-Methyl-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol
CID 130715194
N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine
CID 131067153
(3-Methyl-1,2-thiazol-5-yl)[(2r)-pyrrolidin-2-yl]methanol
CID 164654140
(3-Methyl-1,2-thiazol-5-yl)[(2s)-pyrrolidin-2-yl]methanol
CID 164662104
2-Ethoxy-2-(3-methyl-1,2-thiazol-5-yl)ethan-1-amine
CID 165848493
2-Methoxy-2-(3-methyl-1,2-thiazol-5-yl)ethan-1-amine
CID 165962130

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine?
The IUPAC name of N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine (CID 164646028) is N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine.
What is the SMILES notation for N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine?
The canonical SMILES for N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine is CNC1COC(c2cc(C)ns2)C1.
What is the InChIKey of N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine?
The InChIKey is PKRCERFVXPXWBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1-6-3-9(13-11-6)8-4-7(10-2)5-12-8/h3,7-8,10H,4-5H2,1-2H3.
What are the key properties of N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine?
N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine has a molecular weight of 198.29 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(3-methyl-1,2-thiazol-5-yl)oxolan-3-amine is sourced from PubChem (CID 164646028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).