N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide

C20H23N3O2S — CID 42270576

IUPACN-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESCOc1ccc(-c2cn3c(C(=O)NC4CCCCCC4)csc3n2)cc1
InChIInChI=1S/C20H23N3O2S/c1-25-16-10-8-14(9-11-16)17-12-23-18(13-26-20(23)22-17)19(24)21-15-6-4-2-3-5-7-15/h8-13,15H,2-7H2,1H3,(H,21,24)
InChIKeyKZTMEUBLNYMSLA-UHFFFAOYSA-N
MW369.49 g/mol
LogP4.52
Rot. Bonds4

About N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide

N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide (PubChem CID 42270576) has the molecular formula C20H23N3O2S and a molecular weight of 369.49 g/mol. Its IUPAC name is N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
PubChem CID42270576
Molecular FormulaC20H23N3O2S
Molecular Weight369.49 g/mol
Exact Mass369.15
IUPAC NameN-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESCOc1ccc(-c2cn3c(C(=O)NC4CCCCCC4)csc3n2)cc1
InChIInChI=1S/C20H23N3O2S/c1-25-16-10-8-14(9-11-16)17-12-23-18(13-26-20(23)22-17)19(24)21-15-6-4-2-3-5-7-15/h8-13,15H,2-7H2,1H3,(H,21,24)
InChIKeyKZTMEUBLNYMSLA-UHFFFAOYSA-N
XLogP4.52
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.49
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-methoxyphenyl)-N-(2-phenylphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42270687
N-(5-chloro-2-methylphenyl)-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42270583
N-benzyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42270548
6-(4-methoxyphenyl)-N-(6-methyl-2-pyridinyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42270031
N-(2,4-dimethoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42271416
6-(4-methoxyphenyl)-N-[2-(3-methoxyphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42270727
N-[(4-methoxyphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42271395
[6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 42270017
N-cyclohexyl-4-(4-methoxyphenyl)thiophene-2-carboxamide
CID 3374262
N-(furan-2-ylmethyl)-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42270020
6-[4-[(4-methoxybenzoyl)amino]phenyl]-N,N-dimethylimidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 46396472
6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42270822

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide?
The IUPAC name of N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide (CID 42270576) is N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide.
What is the SMILES notation for N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide?
The canonical SMILES for N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide is COc1ccc(-c2cn3c(C(=O)NC4CCCCCC4)csc3n2)cc1.
What is the InChIKey of N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide?
The InChIKey is KZTMEUBLNYMSLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2S/c1-25-16-10-8-14(9-11-16)17-12-23-18(13-26-20(23)22-17)19(24)21-15-6-4-2-3-5-7-15/h8-13,15H,2-7H2,1H3,(H,21,24).
What are the key properties of N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide?
N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide has a molecular weight of 369.49 g/mol, XLogP of 4.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide is sourced from PubChem (CID 42270576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).