N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine

C11H11BrN2S — CID 22347320

IUPACN-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine
SMILESCCc1csc(Nc2ccc(Br)cc2)n1
InChIInChI=1S/C11H11BrN2S/c1-2-9-7-15-11(13-9)14-10-5-3-8(12)4-6-10/h3-7H,2H2,1H3,(H,13,14)
InChIKeyOGDAHXYDWIVWTQ-UHFFFAOYSA-N
MW283.19 g/mol
LogP4.21
Rot. Bonds3

About N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine

N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine (PubChem CID 22347320) has the molecular formula C11H11BrN2S and a molecular weight of 283.19 g/mol. Its IUPAC name is N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine
PubChem CID22347320
Molecular FormulaC11H11BrN2S
Molecular Weight283.19 g/mol
Exact Mass281.98
IUPAC NameN-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine
SMILESCCc1csc(Nc2ccc(Br)cc2)n1
InChIInChI=1S/C11H11BrN2S/c1-2-9-7-15-11(13-9)14-10-5-3-8(12)4-6-10/h3-7H,2H2,1H3,(H,13,14)
InChIKeyOGDAHXYDWIVWTQ-UHFFFAOYSA-N
XLogP4.21
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.19
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[(4-ethyl-1,3-thiazol-2-yl)amino]phenyl]ethanone
CID 84570012
1-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-N,4-N-diethylbenzene-1,4-diamine;hydrobromide
CID 2877699
4-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-methylbenzoic acid
CID 62963351
4-butyl-N-phenyl-1,3-thiazol-2-amine
CID 141316457
N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine
CID 3551547
N-(4-bromophenyl)-4-[5-(4-bromophenyl)furan-2-yl]-1,3-thiazol-2-amine
CID 4683115
[2-(4-methylanilino)-1,3-thiazol-4-yl]methyl 3-bromobenzoate
CID 7662860
4-ethyl-N-(1,2,3,4-tetrahydroquinolin-6-yl)-1,3-thiazol-2-amine
CID 55173236
2-[2-(4-chloroanilino)-1,3-thiazol-4-yl]acetaldehyde
CID 123698759
2-(2-anilino-1,3-thiazol-4-yl)-N-(4-bromo-2-methylphenyl)acetamide
CID 30940457
4-bromo-N-(6-bromonaphthalen-2-yl)-1,3-thiazol-2-amine
CID 81259901
ethyl 2-[2-(4-carbamoylanilino)-1,3-thiazol-4-yl]acetate
CID 80574072

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine?
The IUPAC name of N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine (CID 22347320) is N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine is CCc1csc(Nc2ccc(Br)cc2)n1.
What is the InChIKey of N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine?
The InChIKey is OGDAHXYDWIVWTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2S/c1-2-9-7-15-11(13-9)14-10-5-3-8(12)4-6-10/h3-7H,2H2,1H3,(H,13,14).
What are the key properties of N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine?
N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine has a molecular weight of 283.19 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-4-ethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 22347320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).