2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol

C20H22N4O2S — CID 50973162

IUPAC2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol
SMILESCOc1ccc(-c2csc(-n3cc(C4=CCN(CCO)CC4)cn3)n2)cc1
InChIInChI=1S/C20H22N4O2S/c1-26-18-4-2-16(3-5-18)19-14-27-20(22-19)24-13-17(12-21-24)15-6-8-23(9-7-15)10-11-25/h2-6,12-14,25H,7-11H2,1H3
InChIKeyIGEQBNSXSRCTRM-UHFFFAOYSA-N
MW382.49 g/mol
LogP3.09
Rot. Bonds6

About 2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol

2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol (PubChem CID 50973162) has the molecular formula C20H22N4O2S and a molecular weight of 382.49 g/mol. Its IUPAC name is 2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol
PubChem CID50973162
Molecular FormulaC20H22N4O2S
Molecular Weight382.49 g/mol
Exact Mass382.15
IUPAC Name2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol
SMILESCOc1ccc(-c2csc(-n3cc(C4=CCN(CCO)CC4)cn3)n2)cc1
InChIInChI=1S/C20H22N4O2S/c1-26-18-4-2-16(3-5-18)19-14-27-20(22-19)24-13-17(12-21-24)15-6-8-23(9-7-15)10-11-25/h2-6,12-14,25H,7-11H2,1H3
InChIKeyIGEQBNSXSRCTRM-UHFFFAOYSA-N
XLogP3.09
TPSA63.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.49
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol 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

methyl 4-[2-(1H-pyrazol-1-yl)-1,3-thiazol-4-yl]phenyl ether
CID 1481752
1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-thienyl)-1H-pyrazol-5-amine
CID 1474403
2-[2-(3,5-Dimethylpyrazol-1-yl)ethyl]-4-(4-methoxyphenyl)-1,3-thiazole
CID 2327975
N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 2555090
1-(2-Pyridinyl)ethanone [4-(4-methoxyphenyl)-1,3-thiazol-2-YL]hydrazone
CID 90481669
1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-pyridinyl)-1H-pyrazol-5-amine
CID 1474438
1H-Pyrazol-5-amine, 3-(4-methoxyphenyl)-1-(4-phenyl-2-thiazolyl)-
CID 852600
2-(3,5-Dimethyl-pyrazol-1-yl)-N-[4-(4-methoxy-phenyl)-thiazol-2-yl]-acetamide
CID 650434
4-[5-[[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]methyl]-4-phenyl-1,2,4-triazol-3-yl]morpholine
CID 2380862
N-[(4-fluoro-3-methoxyphenyl)methyl]-4-methyl-5-[1-[(1-methylpiperidin-3-yl)methyl]pyrazol-3-yl]-1,3-thiazol-2-amine
CID 45166739
N-[3-(diethylamino)propyl]-1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 10005423
4-(4-Methoxyphenyl)-2-[3-(4-pyridyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]thiazole
CID 16124683

Frequently Asked Questions

What is the IUPAC name of 2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol?
The IUPAC name of 2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol (CID 50973162) is 2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol.
What is the SMILES notation for 2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol?
The canonical SMILES for 2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol is COc1ccc(-c2csc(-n3cc(C4=CCN(CCO)CC4)cn3)n2)cc1.
What is the InChIKey of 2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol?
The InChIKey is IGEQBNSXSRCTRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2S/c1-26-18-4-2-16(3-5-18)19-14-27-20(22-19)24-13-17(12-21-24)15-6-8-23(9-7-15)10-11-25/h2-6,12-14,25H,7-11H2,1H3.
What are the key properties of 2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol?
2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol has a molecular weight of 382.49 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrazol-4-yl]-3,6-dihydro-2H-pyridin-1-yl]ethanol is sourced from PubChem (CID 50973162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).