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

C10H16N2OS — CID 131015363

IUPACN-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine
SMILESCNC(c1ccns1)C1CCOC1C
InChIInChI=1S/C10H16N2OS/c1-7-8(4-6-13-7)10(11-2)9-3-5-12-14-9/h3,5,7-8,10-11H,4,6H2,1-2H3
InChIKeyXMHHBLPLHQQTFR-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.83
Rot. Bonds3

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

N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine (PubChem CID 131015363) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine
PubChem CID131015363
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC NameN-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine
SMILESCNC(c1ccns1)C1CCOC1C
InChIInChI=1S/C10H16N2OS/c1-7-8(4-6-13-7)10(11-2)9-3-5-12-14-9/h3,5,7-8,10-11H,4,6H2,1-2H3
InChIKeyXMHHBLPLHQQTFR-UHFFFAOYSA-N
XLogP1.83
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 ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(2-methyloxolan-3-yl)-1-thiophen-2-ylmethanamine
CID 79758920
1-(3,4-dichlorophenyl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 79760213
1-isoquinolin-8-yl-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 103136814
1-(3,4-diethylphenyl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 115482207
1-(4-cyclohexylphenyl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 79755102
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 79758919
N-methyl-1-(2-methyloxolan-3-yl)-1-(2,4,6-trifluorophenyl)methanamine
CID 79758753
N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine
CID 105018149
[(2-methyloxolan-3-yl)-(1,3-thiazol-5-yl)methyl]hydrazine
CID 164650957
1-(5-chloro-2-methoxyphenyl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 113425485
1-(2-chloro-4-methoxyphenyl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 79760034
[(2-methyloxolan-3-yl)-(1,2-thiazol-3-yl)methyl]hydrazine
CID 130604837

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine?
The IUPAC name of N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine (CID 131015363) is N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine is CNC(c1ccns1)C1CCOC1C.
What is the InChIKey of N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine?
The InChIKey is XMHHBLPLHQQTFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-7-8(4-6-13-7)10(11-2)9-3-5-12-14-9/h3,5,7-8,10-11H,4,6H2,1-2H3.
What are the key properties of N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine?
N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine has a molecular weight of 212.32 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-5-yl)methanamine is sourced from PubChem (CID 131015363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).