N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide

C14H14ClN3OS — CID 13192335

IUPACN-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide
SMILESCC1=C(C(=O)Nc2ccc(Cl)cc2C)SC2=NCCN21
InChIInChI=1S/C14H14ClN3OS/c1-8-7-10(15)3-4-11(8)17-13(19)12-9(2)18-6-5-16-14(18)20-12/h3-4,7H,5-6H2,1-2H3,(H,17,19)
InChIKeyKYKOXUWJFCYICJ-UHFFFAOYSA-N
MW307.81 g/mol
LogP3.24
Rot. Bonds2

About N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide

N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide (PubChem CID 13192335) has the molecular formula C14H14ClN3OS and a molecular weight of 307.81 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide
PubChem CID13192335
Molecular FormulaC14H14ClN3OS
Molecular Weight307.81 g/mol
Exact Mass307.05
IUPAC NameN-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide
SMILESCC1=C(C(=O)Nc2ccc(Cl)cc2C)SC2=NCCN21
InChIInChI=1S/C14H14ClN3OS/c1-8-7-10(15)3-4-11(8)17-13(19)12-9(2)18-6-5-16-14(18)20-12/h3-4,7H,5-6H2,1-2H3,(H,17,19)
InChIKeyKYKOXUWJFCYICJ-UHFFFAOYSA-N
XLogP3.24
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.81
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,5-dichlorophenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 13192325
3-methyl-N-(2,4,6-trimethylphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 3048920
4-amino-N-(4-chloro-2-methylphenyl)-5-methylthiophene-2-carboxamide
CID 61093919
5-[(4-chloro-2-methylphenyl)carbamoyl]thiophene-2-carboxylic acid
CID 43414411
N-(4-chloro-2-methylphenyl)-2,4,5-trimethylbenzamide
CID 100708233
3,5-diamino-N-(4-chloro-2-methylphenyl)benzamide
CID 61093328
N-(4-chloro-2-methylphenyl)-1,3-thiazole-4-carboxamide
CID 62045477
N-(4-chloro-2-methylphenyl)-N'-(4,5-dihydro-1,3-thiazol-2-yl)oxamide
CID 108524105
5-chloro-N-(4-chloro-2-methylphenyl)thiophene-2-carboxamide
CID 17432904
N-(4-chloro-2-methylphenyl)-4-methyl-1,3-thiazole-2-carboxamide
CID 110696195
6-[(4-chloro-2-methylphenyl)carbamoyl]pyridine-3-carboxylic acid
CID 43427229
3-(4-chloro-2-methylphenyl)-1,1-dimethylurea
CID 551912

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide (CID 13192335) is N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide is CC1=C(C(=O)Nc2ccc(Cl)cc2C)SC2=NCCN21.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide?
The InChIKey is KYKOXUWJFCYICJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3OS/c1-8-7-10(15)3-4-11(8)17-13(19)12-9(2)18-6-5-16-14(18)20-12/h3-4,7H,5-6H2,1-2H3,(H,17,19).
What are the key properties of N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide?
N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide has a molecular weight of 307.81 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxamide is sourced from PubChem (CID 13192335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).