5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine

C9H11N3OS — CID 131107697

IUPAC5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine
SMILESCc1cnc(CNc2ncc(C)s2)o1
InChIInChI=1S/C9H11N3OS/c1-6-3-10-8(13-6)5-12-9-11-4-7(2)14-9/h3-4H,5H2,1-2H3,(H,11,12)
InChIKeyOJWXGOOKLUQAJY-UHFFFAOYSA-N
MW209.27 g/mol
LogP2.36
Rot. Bonds3

About 5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine

5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine (PubChem CID 131107697) has the molecular formula C9H11N3OS and a molecular weight of 209.27 g/mol. Its IUPAC name is 5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine
PubChem CID131107697
Molecular FormulaC9H11N3OS
Molecular Weight209.27 g/mol
Exact Mass209.06
IUPAC Name5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine
SMILESCc1cnc(CNc2ncc(C)s2)o1
InChIInChI=1S/C9H11N3OS/c1-6-3-10-8(13-6)5-12-9-11-4-7(2)14-9/h3-4H,5H2,1-2H3,(H,11,12)
InChIKeyOJWXGOOKLUQAJY-UHFFFAOYSA-N
XLogP2.36
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(5-methyl-1,3-oxazol-2-yl)methyl]-5-nitro-1,3-thiazol-2-amine
CID 106373712
5-bromo-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 107143525
3-tert-butyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,2,4-thiadiazol-5-amine
CID 104952788
[5-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]furan-2-yl]methanol
CID 115912749
N-[(5-chlorothiophen-2-yl)methyl]-5-methyl-1,3-thiazol-2-amine
CID 83301712
5-chloro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-benzothiazol-2-amine
CID 106375173
2-N-ethyl-6-methyl-4-N-[(5-methyl-1,3-oxazol-2-yl)methyl]thieno[2,3-d]pyrimidine-2,4-diamine
CID 106378642
N-(methoxymethyl)-5-methyl-1,3-thiazol-2-amine
CID 59059026
5-methyl-2-[2-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,3-oxazole
CID 148627248
3-bromo-5-fluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]aniline
CID 84587908
6-ethoxy-4-N-ethyl-2-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 106378619
ethyl 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]-1,3-thiazole-4-carboxylate
CID 106378348

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of 5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine (CID 131107697) is 5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine is Cc1cnc(CNc2ncc(C)s2)o1.
What is the InChIKey of 5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine?
The InChIKey is OJWXGOOKLUQAJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3OS/c1-6-3-10-8(13-6)5-12-9-11-4-7(2)14-9/h3-4H,5H2,1-2H3,(H,11,12).
What are the key properties of 5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine?
5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine has a molecular weight of 209.27 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 131107697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).