N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide

C9H7BrN2OS2 — CID 854410

IUPACN-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(-c2ccc(Br)s2)cs1
InChIInChI=1S/C9H7BrN2OS2/c1-5(13)11-9-12-6(4-14-9)7-2-3-8(10)15-7/h2-4H,1H3,(H,11,12,13)
InChIKeyPRHFTISODISOTF-UHFFFAOYSA-N
MW303.21 g/mol
LogP3.59
Rot. Bonds2

About N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide

N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide (PubChem CID 854410) has the molecular formula C9H7BrN2OS2 and a molecular weight of 303.21 g/mol. Its IUPAC name is N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide
PubChem CID854410
Molecular FormulaC9H7BrN2OS2
Molecular Weight303.21 g/mol
Exact Mass301.92
IUPAC NameN-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(-c2ccc(Br)s2)cs1
InChIInChI=1S/C9H7BrN2OS2/c1-5(13)11-9-12-6(4-14-9)7-2-3-8(10)15-7/h2-4H,1H3,(H,11,12,13)
InChIKeyPRHFTISODISOTF-UHFFFAOYSA-N
XLogP3.59
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.21
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[2-(4-bromoanilino)-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
CID 1186941
4-(5-Bromothiophen-2-yl)-1,3-thiazol-2-amine
CID 725239
5-bromo-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 2442289
5-Bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine
CID 658268
N-[4-(4,5-dichlorothiophen-2-yl)-1,3-thiazol-2-yl]acetamide
CID 2740553
N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]butanamide
CID 5098079
N-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]acetamide
CID 693802
N-{[5-(2-amino-1,3-thiazol-4-yl)thiophen-2-yl]methyl}acetamide
CID 2560398
N-[[5-[2-[(N'-butylcarbamimidoyl)amino]-1,3-thiazol-4-yl]thiophen-2-yl]methyl]acetamide
CID 9884839
Acetic acid, oxo((4-(2-thienyl)-2-thiazolyl)amino)-
CID 3068157
3-(benzenesulfonyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)propanamide
CID 7189641
4,5-dibromo-N-(4-tert-butyl-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 71651924

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide (CID 854410) is N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1nc(-c2ccc(Br)s2)cs1.
What is the InChIKey of N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is PRHFTISODISOTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7BrN2OS2/c1-5(13)11-9-12-6(4-14-9)7-2-3-8(10)15-7/h2-4H,1H3,(H,11,12,13).
What are the key properties of N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide?
N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 303.21 g/mol, XLogP of 3.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 854410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).