1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine

C8H9N3OS — CID 106414886

IUPAC1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
SMILESc1cc(CNCc2nccs2)on1
InChIInChI=1S/C8H9N3OS/c1-2-11-12-7(1)5-9-6-8-10-3-4-13-8/h1-4,9H,5-6H2
InChIKeyAKZXBRUPEYLIRD-UHFFFAOYSA-N
MW195.25 g/mol
LogP1.42
Rot. Bonds4

About 1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine

1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine (PubChem CID 106414886) has the molecular formula C8H9N3OS and a molecular weight of 195.25 g/mol. Its IUPAC name is 1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
PubChem CID106414886
Molecular FormulaC8H9N3OS
Molecular Weight195.25 g/mol
Exact Mass195.05
IUPAC Name1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
SMILESc1cc(CNCc2nccs2)on1
InChIInChI=1S/C8H9N3OS/c1-2-11-12-7(1)5-9-6-8-10-3-4-13-8/h1-4,9H,5-6H2
InChIKeyAKZXBRUPEYLIRD-UHFFFAOYSA-N
XLogP1.42
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.25
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1,2-oxazol-5-yl)-N-(1,2-oxazol-5-ylmethyl)methanamine
CID 165349203
1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine;dihydrochloride
CID 56773667
1-(4-fluorophenyl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 60962189
1-phenyl-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 4777619
1-(3,4-difluorophenyl)-N-(1,3-thiazol-2-ylmethyl)methanamine;hydrochloride
CID 155977994
1-(4-fluorophenyl)-N-(1,2-oxazol-5-ylmethyl)methanamine
CID 103605027
2-(1,2-oxazol-5-ylmethylamino)acetamide
CID 103605544
2-[(1,3-thiazol-2-ylmethylamino)methyl]phenol
CID 61284615
N-(1,2-oxazol-5-ylmethyl)formamide
CID 87408226
1-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 63378422
2-(1,2,4-oxadiazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine
CID 103744486
1-(1H-pyrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 61286025

Frequently Asked Questions

What is the IUPAC name of 1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The IUPAC name of 1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine (CID 106414886) is 1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine.
What is the SMILES notation for 1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The canonical SMILES for 1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine is c1cc(CNCc2nccs2)on1.
What is the InChIKey of 1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
The InChIKey is AKZXBRUPEYLIRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3OS/c1-2-11-12-7(1)5-9-6-8-10-3-4-13-8/h1-4,9H,5-6H2.
What are the key properties of 1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine?
1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine has a molecular weight of 195.25 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-oxazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine is sourced from PubChem (CID 106414886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).