5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine

C11H12N2S — CID 16770159

IUPAC5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine
SMILESCc1ccccc1Cc1cnc(N)s1
InChIInChI=1S/C11H12N2S/c1-8-4-2-3-5-9(8)6-10-7-13-11(12)14-10/h2-5,7H,6H2,1H3,(H2,12,13)
InChIKeyHVBQNABRJKMLAU-UHFFFAOYSA-N
MW204.30 g/mol
LogP2.62
Rot. Bonds2

About 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine

5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine (PubChem CID 16770159) has the molecular formula C11H12N2S and a molecular weight of 204.30 g/mol. Its IUPAC name is 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine
PubChem CID16770159
Molecular FormulaC11H12N2S
Molecular Weight204.30 g/mol
Exact Mass204.07
IUPAC Name5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine
SMILESCc1ccccc1Cc1cnc(N)s1
InChIInChI=1S/C11H12N2S/c1-8-4-2-3-5-9(8)6-10-7-13-11(12)14-10/h2-5,7H,6H2,1H3,(H2,12,13)
InChIKeyHVBQNABRJKMLAU-UHFFFAOYSA-N
XLogP2.62
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.30
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Amiphenazole
CID 10275
5-Benzyl-1,3-thiazol-2-amine
CID 691952
Thiourea, N-(2-(2-methylphenyl)ethyl)-N'-2-thiazolyl-
CID 3001167
5-(4-Bromobenzyl)-1,3-thiazol-2-amine
CID 727750
5-methyl-N-(2-phenylethyl)-1,3-thiazol-2-amine
CID 935229
5-{[4-(Trifluoromethyl)phenyl]methyl}-1,3-thiazol-2-amine
CID 16228111
5-[(4-Chlorophenyl)methyl]-1,3-thiazol-2-amine
CID 701041
5-[(3-Chlorophenyl)methyl]-1,3-thiazol-2-amine
CID 795027
5-Phenyl-thiazol-2-ylamine
CID 873119
5-Phenylthiazole
CID 595209
[[[5-(2-Phenylethyl)-1,3-thiazol-2-yl]amino]-phosphonomethyl]phosphonic acid
CID 11143347
5-benzyl-N-methyl-1,3-thiazol-2-amine
CID 1229694

Frequently Asked Questions

What is the IUPAC name of 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine (CID 16770159) is 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine is Cc1ccccc1Cc1cnc(N)s1.
What is the InChIKey of 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
The InChIKey is HVBQNABRJKMLAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2S/c1-8-4-2-3-5-9(8)6-10-7-13-11(12)14-10/h2-5,7H,6H2,1H3,(H2,12,13).
What are the key properties of 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine has a molecular weight of 204.30 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 16770159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).