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

C10H16N2OS — CID 126985750

IUPAC(1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine
SMILESCOC1(C(N)c2cc(C)ns2)CCC1
InChIInChI=1S/C10H16N2OS/c1-7-6-8(14-12-7)9(11)10(13-2)4-3-5-10/h6,9H,3-5,11H2,1-2H3
InChIKeyCVEWIJOQGIBTAY-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.02
Rot. Bonds3

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

(1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine (PubChem CID 126985750) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is (1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine.

Molecular Properties

Compound Name(1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine
PubChem CID126985750
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name(1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine
SMILESCOC1(C(N)c2cc(C)ns2)CCC1
InChIInChI=1S/C10H16N2OS/c1-7-6-8(14-12-7)9(11)10(13-2)4-3-5-10/h6,9H,3-5,11H2,1-2H3
InChIKeyCVEWIJOQGIBTAY-UHFFFAOYSA-N
XLogP2.02
TPSA48.14 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 ≤ 52.02
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-Methoxycyclopentyl)-(1,2-thiazol-3-yl)methanamine
CID 130631850
(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
(2-Methyloxolan-2-yl)-(1,2-thiazol-3-yl)methanamine
CID 130956228
(1-Methoxycyclobutyl)-(1,2-thiazol-5-yl)methanamine
CID 131172129
(3-Methyl-1,2-thiazol-5-yl)-(oxan-3-yl)methanamine
CID 131183022
1-Methoxy-2-(3-methyl-1,2-thiazol-5-yl)propan-2-amine
CID 131191330

Frequently Asked Questions

What is the IUPAC name of (1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine?
The IUPAC name of (1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine (CID 126985750) is (1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine.
What is the SMILES notation for (1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine?
The canonical SMILES for (1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine is COC1(C(N)c2cc(C)ns2)CCC1.
What is the InChIKey of (1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine?
The InChIKey is CVEWIJOQGIBTAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-7-6-8(14-12-7)9(11)10(13-2)4-3-5-10/h6,9H,3-5,11H2,1-2H3.
What are the key properties of (1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine?
(1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine has a molecular weight of 212.32 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycyclobutyl)-(3-methyl-1,2-thiazol-5-yl)methanamine is sourced from PubChem (CID 126985750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).