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

C10H16N2OS — CID 130642110

IUPACN-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine
SMILESCNC(c1ccsn1)C1CCCCO1
InChIInChI=1S/C10H16N2OS/c1-11-10(8-5-7-14-12-8)9-4-2-3-6-13-9/h5,7,9-11H,2-4,6H2,1H3
InChIKeyBWROKHSJSHVTFR-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.97
Rot. Bonds3

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

N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine (PubChem CID 130642110) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine
PubChem CID130642110
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC NameN-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine
SMILESCNC(c1ccsn1)C1CCCCO1
InChIInChI=1S/C10H16N2OS/c1-11-10(8-5-7-14-12-8)9-4-2-3-6-13-9/h5,7,9-11H,2-4,6H2,1H3
InChIKeyBWROKHSJSHVTFR-UHFFFAOYSA-N
XLogP1.97
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 ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-Bis(fluoromethyl)-9-(1,2-thiazol-3-yl)-5-oxa-8-azaspiro[3.5]nonane
CID 165863125
9,9-Difluoro-5-(1,2-thiazol-3-yl)-1-oxa-4-azaspiro[5.5]undecane
CID 165865815
2-(5-Methyl-1,2-thiazol-3-yl)piperidin-3-ol
CID 112488164
Oxolan-2-yl(1,2-thiazol-3-yl)methanamine
CID 126985781
2-(Oxolan-2-yl)-1-(1,2-thiazol-3-yl)ethanamine
CID 127002582
1-(1,4-dioxan-2-yl)-N-methyl-1-(1,2-thiazol-3-yl)methanamine
CID 130604848
N-methyl-1-(oxan-4-yl)-1-(1,2-thiazol-3-yl)methanamine
CID 130625427
Oxan-2-yl(1,2-thiazol-3-yl)methanamine
CID 130665539
(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
N-methyl-1-(2-methyloxolan-3-yl)-1-(1,2-thiazol-3-yl)methanamine
CID 130875435
N-methyl-1-(3-methyl-1,2-thiazol-5-yl)-1-(oxolan-2-yl)methanamine
CID 131067153

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine?
The IUPAC name of N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine (CID 130642110) is N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine?
The canonical SMILES for N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine is CNC(c1ccsn1)C1CCCCO1.
What is the InChIKey of N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine?
The InChIKey is BWROKHSJSHVTFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-11-10(8-5-7-14-12-8)9-4-2-3-6-13-9/h5,7,9-11H,2-4,6H2,1H3.
What are the key properties of N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine?
N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine has a molecular weight of 212.32 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(oxan-2-yl)-1-(1,2-thiazol-3-yl)methanamine is sourced from PubChem (CID 130642110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).