4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide

C22H26N4O2S — CID 146041903

IUPAC4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide
SMILESCNC(=O)C1CCC(Cn2ccnc2-c2cnc(-c3cccc(OC)c3)s2)CC1
InChIInChI=1S/C22H26N4O2S/c1-23-21(27)16-8-6-15(7-9-16)14-26-11-10-24-20(26)19-13-25-22(29-19)17-4-3-5-18(12-17)28-2/h3-5,10-13,15-16H,6-9,14H2,1-2H3,(H,23,27)
InChIKeyGWZIXGKTCFXVJS-UHFFFAOYSA-N
MW410.54 g/mol
LogP4.23
Rot. Bonds6

About 4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide

4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide (PubChem CID 146041903) has the molecular formula C22H26N4O2S and a molecular weight of 410.54 g/mol. Its IUPAC name is 4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide
PubChem CID146041903
Molecular FormulaC22H26N4O2S
Molecular Weight410.54 g/mol
Exact Mass410.18
IUPAC Name4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide
SMILESCNC(=O)C1CCC(Cn2ccnc2-c2cnc(-c3cccc(OC)c3)s2)CC1
InChIInChI=1S/C22H26N4O2S/c1-23-21(27)16-8-6-15(7-9-16)14-26-11-10-24-20(26)19-13-25-22(29-19)17-4-3-5-18(12-17)28-2/h3-5,10-13,15-16H,6-9,14H2,1-2H3,(H,23,27)
InChIKeyGWZIXGKTCFXVJS-UHFFFAOYSA-N
XLogP4.23
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.54
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]pyrrolidin-2-one
CID 166624170
cis-(1R,3S)-3-amino-N-[[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]methyl]cyclopentane-1-carboxamide
CID 133136628
1-(3-methoxyphenyl)-4-[4-[(2-phenylimidazol-1-yl)methyl]piperidine-1-carbonyl]pyrrolidin-2-one
CID 90493015
N-methyl-2-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]acetamide
CID 90494467
3-(3-methoxyphenyl)-N-[4-(methylcarbamoyl)cyclohexyl]-1-(4-methylphenyl)pyrazole-4-carboxamide
CID 47083532
2-(3-methoxyphenoxy)-1-[4-[(2-methylimidazol-1-yl)methyl]piperidin-1-yl]ethanone
CID 90493100
3-(4-methoxyphenyl)-1-[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]propan-1-one
CID 90493537
1-(3-methoxyphenyl)-2-(2-phenylimidazol-1-yl)ethanol
CID 110907755
N-[(2R,3R)-1-[[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-methyl-1-oxopentan-2-yl]cyclopropanecarboxamide
CID 7283343
2-[[2-(3-methoxyphenyl)imidazol-1-yl]methyl]benzoic acid
CID 82560569
N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-(3-methoxyphenyl)-1,3-thiazole-2-carboxamide
CID 10154517
[4-(cyclopropylmethyl)-2-(3-methoxyphenyl)-5,6-dihydropyrrolo[3,2-d][1,3]thiazol-5-yl]-(4-methylpiperazin-1-yl)methanone
CID 131652583

Frequently Asked Questions

What is the IUPAC name of 4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide?
The IUPAC name of 4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide (CID 146041903) is 4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide?
The canonical SMILES for 4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide is CNC(=O)C1CCC(Cn2ccnc2-c2cnc(-c3cccc(OC)c3)s2)CC1.
What is the InChIKey of 4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide?
The InChIKey is GWZIXGKTCFXVJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O2S/c1-23-21(27)16-8-6-15(7-9-16)14-26-11-10-24-20(26)19-13-25-22(29-19)17-4-3-5-18(12-17)28-2/h3-5,10-13,15-16H,6-9,14H2,1-2H3,(H,23,27).
What are the key properties of 4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide?
4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide has a molecular weight of 410.54 g/mol, XLogP of 4.23, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]imidazol-1-yl]methyl]-N-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 146041903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).