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

C10H16N2OS — CID 61284247

IUPAC1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
SMILESc1csc(CNCC2CCCCO2)n1
InChIInChI=1S/C10H16N2OS/c1-2-5-13-9(3-1)7-11-8-10-12-4-6-14-10/h4,6,9,11H,1-3,5,7-8H2
InChIKeyQIBVSONVUXZDIN-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.80
Rot. Bonds4

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

1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine (PubChem CID 61284247) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
PubChem CID61284247
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
SMILESc1csc(CNCC2CCCCO2)n1
InChIInChI=1S/C10H16N2OS/c1-2-5-13-9(3-1)7-11-8-10-12-4-6-14-10/h4,6,9,11H,1-3,5,7-8H2
InChIKeyQIBVSONVUXZDIN-UHFFFAOYSA-N
XLogP1.80
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1,4-dioxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 63002116
1-cyclopropyl-N-(1,3-thiazol-2-ylmethyl)methanamine;dihydrochloride
CID 155973425
4-[(1,3-thiazol-2-ylmethylamino)methyl]cyclohexan-1-ol
CID 106125249
N-(oxolan-2-ylmethyl)-3-(1,3-thiazol-2-yl)propanamide
CID 90013649
N-[(2-methylpyrimidin-4-yl)methyl]-1-(oxan-2-yl)methanamine
CID 61015871
[4-[(1,3-thiazol-2-ylmethylamino)methyl]cyclohexyl]methanamine
CID 79533036
N-[(6-chloro-3-pyridinyl)methyl]-1-(oxan-2-yl)methanamine
CID 115683652
N-[(3,5-dichlorophenyl)methyl]-1-(oxan-2-yl)methanamine
CID 55014706
1-(2,3-dihydro-1-benzofuran-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 62998098
benzyl 2-[(1,3-thiazol-2-ylmethylamino)methyl]morpholine-4-carboxylate
CID 107254883
N-[(4-bromo-5-methylthiophen-2-yl)methyl]-1-(oxan-2-yl)methanamine
CID 102835096
N-(furan-2-ylmethyl)-1-(oxan-2-yl)methanamine
CID 43403599

Frequently Asked Questions

What is the IUPAC name of 1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The IUPAC name of 1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine (CID 61284247) is 1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine.
What is the SMILES notation for 1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The canonical SMILES for 1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine is c1csc(CNCC2CCCCO2)n1.
What is the InChIKey of 1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The InChIKey is QIBVSONVUXZDIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-2-5-13-9(3-1)7-11-8-10-12-4-6-14-10/h4,6,9,11H,1-3,5,7-8H2.
What are the key properties of 1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine has a molecular weight of 212.32 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine is sourced from PubChem (CID 61284247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).