[4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone

C25H22N2O2S — CID 154732384

IUPAC[4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone
SMILESCc1ccc(-c2nc(N3CCOCC3)sc2C(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C25H22N2O2S/c1-17-9-11-19(12-10-17)22-24(30-25(26-22)27-13-15-29-16-14-27)23(28)21-8-4-6-18-5-2-3-7-20(18)21/h2-12H,13-16H2,1H3
InChIKeyUMYICYJIZXJEOY-UHFFFAOYSA-N
MW414.53 g/mol
LogP5.34
Rot. Bonds4

About [4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone

[4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone (PubChem CID 154732384) has the molecular formula C25H22N2O2S and a molecular weight of 414.53 g/mol. Its IUPAC name is [4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone.

Molecular Properties

Compound Name[4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone
PubChem CID154732384
Molecular FormulaC25H22N2O2S
Molecular Weight414.53 g/mol
Exact Mass414.14
IUPAC Name[4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone
SMILESCc1ccc(-c2nc(N3CCOCC3)sc2C(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C25H22N2O2S/c1-17-9-11-19(12-10-17)22-24(30-25(26-22)27-13-15-29-16-14-27)23(28)21-8-4-6-18-5-2-3-7-20(18)21/h2-12H,13-16H2,1H3
InChIKeyUMYICYJIZXJEOY-UHFFFAOYSA-N
XLogP5.34
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.53
LogP ≤ 55.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone 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

2-[4-(4-hydroxyphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]ethene-1,1,2-tricarbonitrile
CID 15425581
5-hydroxypentyl 2-morpholin-4-yl-4-phenyl-1,3-thiazole-5-carboxylate
CID 167862109
N-(4-methylphenyl)-4-phenyl-2-pyrrolidin-1-yl-1,3-thiazole-5-carboxamide
CID 18859801
N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)naphthalene-1-carboxamide
CID 9405180
2-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]-4-phenyl-1,3-thiazole-5-carboxamide
CID 2144787
(2,4-dichlorophenyl)-(4-hydroxy-2-morpholin-4-yl-1,3-thiazol-5-yl)methanone
CID 10361076
4-methyl-N'-[2-(4-methylphenyl)acetyl]-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide
CID 17446856
N'-[2-(furan-2-yl)-4-phenyl-1,3-thiazole-5-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide
CID 36757551
N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)naphthalene-1-carboxamide
CID 29138372
N-(6-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)naphthalene-1-carboxamide;hydrochloride
CID 44935094
N'-(3-chloro-1-benzothiophene-2-carbonyl)-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide
CID 25446089
[5-methyl-6-(2-morpholin-4-ylethyl)thieno[2,3-b]pyrrol-4-yl]-naphthalen-1-ylmethanone
CID 53358257

Frequently Asked Questions

What is the IUPAC name of [4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone?
The IUPAC name of [4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone (CID 154732384) is [4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone.
What is the SMILES notation for [4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone?
The canonical SMILES for [4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone is Cc1ccc(-c2nc(N3CCOCC3)sc2C(=O)c2cccc3ccccc23)cc1.
What is the InChIKey of [4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone?
The InChIKey is UMYICYJIZXJEOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N2O2S/c1-17-9-11-19(12-10-17)22-24(30-25(26-22)27-13-15-29-16-14-27)23(28)21-8-4-6-18-5-2-3-7-20(18)21/h2-12H,13-16H2,1H3.
What are the key properties of [4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone?
[4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone has a molecular weight of 414.53 g/mol, XLogP of 5.34, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methylphenyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-naphthalen-1-ylmethanone is sourced from PubChem (CID 154732384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).