N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide

C15H14ClN3OS — CID 44530229

IUPACN-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESCc1nc2sccn2c1C(=O)NCCc1ccccc1Cl
InChIInChI=1S/C15H14ClN3OS/c1-10-13(19-8-9-21-15(19)18-10)14(20)17-7-6-11-4-2-3-5-12(11)16/h2-5,8-9H,6-7H2,1H3,(H,17,20)
InChIKeyRRAJNVPFINUTLX-UHFFFAOYSA-N
MW319.82 g/mol
LogP3.33
Rot. Bonds4

About N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide

N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide (PubChem CID 44530229) has the molecular formula C15H14ClN3OS and a molecular weight of 319.82 g/mol. Its IUPAC name is N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound NameN-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide
PubChem CID44530229
Molecular FormulaC15H14ClN3OS
Molecular Weight319.82 g/mol
Exact Mass319.05
IUPAC NameN-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESCc1nc2sccn2c1C(=O)NCCc1ccccc1Cl
InChIInChI=1S/C15H14ClN3OS/c1-10-13(19-8-9-21-15(19)18-10)14(20)17-7-6-11-4-2-3-5-12(11)16/h2-5,8-9H,6-7H2,1H3,(H,17,20)
InChIKeyRRAJNVPFINUTLX-UHFFFAOYSA-N
XLogP3.33
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.82
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[4-(2-chloro-3-ethylphenyl)piperazin-1-yl]butyl]-5-methylimidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 155564667
Imidazo[2,1-b]thiazole-5-carboxamide, N-[[(2S)-1-[[2-amino-5-(3-methylphenyl)-4-thiazolyl]carbonyl]-2-azetidinyl]methyl]-6-chloro-
CID 24737677
N-[2-(3-Chlorophenyl)ethyl]-3-(4-Methylphenyl)imidazo[2,1-B][1,3]thiazole-5-Carboxamide
CID 118716433
(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 2312959
2-(6-(4-chlorophenyl)imidazo[2,1-b]thiazol-3-yl)-N-(3-(diethylamino)propyl)acetamide
CID 7522241
Imidazo[2,1-b]thiazole-5-carboxamide, 6-methyl-N-phenyl-
CID 12318051
N-[(2-chlorophenyl)methyl]-6-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 16029630
N-(5-chloro-2-methylphenyl)-3-methyl-6-phenylimidazo[2,1-b]thiazole-2-carboxamide
CID 16034674
5-N-[(1R)-1-phenylethyl]-4-N-(1,3-thiazol-2-yl)-1H-imidazole-4,5-dicarboxamide
CID 42601279
5-N-[(1S)-1-phenylethyl]-4-N-(1,3-thiazol-2-yl)-1H-imidazole-4,5-dicarboxamide
CID 42601280
N5-methyl-N5-(phenylmethyl)-N4-(2-thiazolyl)-1H-imidazole-4,5-dicarboxamide
CID 44142711
N-(1-benzylpiperidin-4-yl)-6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 44525186

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide?
The IUPAC name of N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide (CID 44530229) is N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide.
What is the SMILES notation for N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide?
The canonical SMILES for N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide is Cc1nc2sccn2c1C(=O)NCCc1ccccc1Cl.
What is the InChIKey of N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide?
The InChIKey is RRAJNVPFINUTLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3OS/c1-10-13(19-8-9-21-15(19)18-10)14(20)17-7-6-11-4-2-3-5-12(11)16/h2-5,8-9H,6-7H2,1H3,(H,17,20).
What are the key properties of N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide?
N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide has a molecular weight of 319.82 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chlorophenyl)ethyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 44530229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).