1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine

C8H14N2OS — CID 131191330

IUPAC1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine
SMILESCOCC(C)(N)c1cc(C)ns1
InChIInChI=1S/C8H14N2OS/c1-6-4-7(12-10-6)8(2,9)5-11-3/h4H,5,9H2,1-3H3
InChIKeyQMAJUTAVNJVWPD-UHFFFAOYSA-N
MW186.28 g/mol
LogP1.27
Rot. Bonds3

About 1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine

1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine (PubChem CID 131191330) has the molecular formula C8H14N2OS and a molecular weight of 186.28 g/mol. Its IUPAC name is 1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine.

Molecular Properties

Compound Name1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine
PubChem CID131191330
Molecular FormulaC8H14N2OS
Molecular Weight186.28 g/mol
Exact Mass186.08
IUPAC Name1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine
SMILESCOCC(C)(N)c1cc(C)ns1
InChIInChI=1S/C8H14N2OS/c1-6-4-7(12-10-6)8(2,9)5-11-3/h4H,5,9H2,1-3H3
InChIKeyQMAJUTAVNJVWPD-UHFFFAOYSA-N
XLogP1.27
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,2,2-Trimethoxy-1-(3-methyl-5-isothiazolyl)ethylamine
CID 24971822
(3-Methyl-1,2-thiazol-5-yl)-(oxolan-2-yl)methanamine
CID 126985716
(1-Methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine
CID 126985750
(5-Methyloxolan-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanamine
CID 130642281
(3-Methyloxolan-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanamine
CID 130662906
3-(3-Methyl-1,2-thiazol-5-yl)oxan-3-amine
CID 130664346
(3-Methyl-1,2-thiazol-5-yl)-(oxan-2-yl)methanamine
CID 130673408
2-Methoxy-1-(3-methyl-1,2-thiazol-5-yl)ethanamine
CID 130752204
4-(3-Methyl-1,2-thiazol-5-yl)oxepan-4-amine
CID 131011067

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine?
The IUPAC name of 1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine (CID 131191330) is 1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine.
What is the SMILES notation for 1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine?
The canonical SMILES for 1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine is COCC(C)(N)c1cc(C)ns1.
What is the InChIKey of 1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine?
The InChIKey is QMAJUTAVNJVWPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2OS/c1-6-4-7(12-10-6)8(2,9)5-11-3/h4H,5,9H2,1-3H3.
What are the key properties of 1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine?
1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine has a molecular weight of 186.28 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine is sourced from PubChem (CID 131191330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).