N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide

C9H8ClN3OS — CID 69412666

IUPACN-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(-c2ccc(Cl)s2)[nH]1
InChIInChI=1S/C9H8ClN3OS/c1-5(14)12-9-11-4-6(13-9)7-2-3-8(10)15-7/h2-4H,1H3,(H2,11,12,13,14)
InChIKeyVVAKPEPLWQNRFF-UHFFFAOYSA-N
MW241.70 g/mol
LogP2.75
Rot. Bonds2

About N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide

N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide (PubChem CID 69412666) has the molecular formula C9H8ClN3OS and a molecular weight of 241.70 g/mol. Its IUPAC name is N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide
PubChem CID69412666
Molecular FormulaC9H8ClN3OS
Molecular Weight241.70 g/mol
Exact Mass241.01
IUPAC NameN-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(-c2ccc(Cl)s2)[nH]1
InChIInChI=1S/C9H8ClN3OS/c1-5(14)12-9-11-4-6(13-9)7-2-3-8(10)15-7/h2-4H,1H3,(H2,11,12,13,14)
InChIKeyVVAKPEPLWQNRFF-UHFFFAOYSA-N
XLogP2.75
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.70
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(5-chlorothiophen-2-yl)-1H-imidazol-2-amine
CID 64983084
5-(5-chlorothiophen-2-yl)-1H-imidazol-2-amine;sulfuric acid
CID 71757494
N-[5-(4-methyl-1,3-thiazol-2-yl)-1H-imidazol-2-yl]acetamide
CID 175942041
[1-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]cyclopropyl]methanamine
CID 116882099
2-(azetidin-3-yl)-5-(5-chlorothiophen-2-yl)-1H-imidazole
CID 116877436
N-[5-(5-chlorothiophen-2-yl)-1H-pyrazol-3-yl]-1H-pyrazole-5-carboxamide
CID 75390552
2-(5-chlorothiophen-2-yl)-5-methyl-1,3-thiazole
CID 59009299
methyl N-(5-phenyl-1H-imidazol-2-yl)carbamate
CID 141231545
4-(5-chlorothiophen-2-yl)-1,3-dihydroimidazol-2-one
CID 116879669
5-(5-chlorothiophen-2-yl)-N-methylpyrimidin-2-amine
CID 116976967
2-[[5-(5-chlorothiophen-2-yl)-1H-pyrazole-3-carbonyl]amino]acetic acid
CID 66591784
4-(5-chlorothiophen-2-yl)pyrimidine-2-carboxamide
CID 116904013

Frequently Asked Questions

What is the IUPAC name of N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide?
The IUPAC name of N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide (CID 69412666) is N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide.
What is the SMILES notation for N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide?
The canonical SMILES for N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide is CC(=O)Nc1ncc(-c2ccc(Cl)s2)[nH]1.
What is the InChIKey of N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide?
The InChIKey is VVAKPEPLWQNRFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3OS/c1-5(14)12-9-11-4-6(13-9)7-2-3-8(10)15-7/h2-4H,1H3,(H2,11,12,13,14).
What are the key properties of N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide?
N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide has a molecular weight of 241.70 g/mol, XLogP of 2.75, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5-chlorothiophen-2-yl)-1H-imidazol-2-yl]acetamide is sourced from PubChem (CID 69412666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).