[1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone

C20H24N2O3S — CID 24820095

IUPAC[1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone
SMILESCc1nc(C(=O)N2CCCC(C(=O)c3cccc(OC(C)C)c3)C2)cs1
InChIInChI=1S/C20H24N2O3S/c1-13(2)25-17-8-4-6-15(10-17)19(23)16-7-5-9-22(11-16)20(24)18-12-26-14(3)21-18/h4,6,8,10,12-13,16H,5,7,9,11H2,1-3H3
InChIKeyHBELEGFGZVOWMW-UHFFFAOYSA-N
MW372.49 g/mol
LogP3.97
Rot. Bonds5

About [1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone

[1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone (PubChem CID 24820095) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is [1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone.

Molecular Properties

Compound Name[1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone
PubChem CID24820095
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC Name[1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone
SMILESCc1nc(C(=O)N2CCCC(C(=O)c3cccc(OC(C)C)c3)C2)cs1
InChIInChI=1S/C20H24N2O3S/c1-13(2)25-17-8-4-6-15(10-17)19(23)16-7-5-9-22(11-16)20(24)18-12-26-14(3)21-18/h4,6,8,10,12-13,16H,5,7,9,11H2,1-3H3
InChIKeyHBELEGFGZVOWMW-UHFFFAOYSA-N
XLogP3.97
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone 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-Methoxybenzyl)-1,3-thiazol-4-yl](piperidino)methanone
CID 1472641
(2,5-Dimethoxyphenyl)[4-({4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1-piperazinyl}carbonyl)phenyl]methanone
CID 2945389
(3-Methoxyphenyl){1-[3-(4-methyl-1,3-thiazol-5-yl)propanoyl]piperidin-3-yl}methanone
CID 16188401
4-[(1-acetyl-4-piperidinyl)oxy]-3-methoxy-N-[(4-methyl-1,3-thiazol-2-yl)methyl]benzamide
CID 24816675
3-Methoxy-N-({2-[(4-methylphenoxy)methyl]-1,3-thiazol-4-YL}methyl)-N-(2-methylpropyl)benzamide
CID 46009273
[2-(4-Methoxybenzyl)-1,3-thiazol-4-yl](morpholino)methanone
CID 1472612
3-[(1-acetyl-4-piperidinyl)oxy]-4-methoxy-N-[(2-methyl-1,3-thiazol-4-yl)methyl]benzamide
CID 24790194
4-{[1-(3-methoxypropanoyl)-4-piperidinyl]oxy}-N-[(2-methyl-1,3-thiazol-4-yl)methyl]benzamide
CID 24819478
N-methyl-2-{[1-(methylsulfonyl)-4-piperidinyl]oxy}-N-[(2-methyl-1,3-thiazol-4-yl)methyl]benzamide
CID 16189529
3-{1-[(2-isopropyl-1,3-thiazol-4-yl)carbonyl]piperidin-3-yl}-N-(3-methoxybenzyl)propanamide
CID 16190929
(3-Isopropoxyphenyl)[1-(1,2,3-thiadiazol-4-ylcarbonyl)piperidin-3-yl]methanone
CID 16192453
(4-Methoxy-3,5-dimethylphenyl){1-[(2-methyl-1,3-thiazol-4-yl)carbonyl]-3-piperidinyl}methanone
CID 24790856

Frequently Asked Questions

What is the IUPAC name of [1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone?
The IUPAC name of [1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone (CID 24820095) is [1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone.
What is the SMILES notation for [1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone?
The canonical SMILES for [1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone is Cc1nc(C(=O)N2CCCC(C(=O)c3cccc(OC(C)C)c3)C2)cs1.
What is the InChIKey of [1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone?
The InChIKey is HBELEGFGZVOWMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-13(2)25-17-8-4-6-15(10-17)19(23)16-7-5-9-22(11-16)20(24)18-12-26-14(3)21-18/h4,6,8,10,12-13,16H,5,7,9,11H2,1-3H3.
What are the key properties of [1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone?
[1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone has a molecular weight of 372.49 g/mol, XLogP of 3.97, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(3-propan-2-yloxyphenyl)methanone is sourced from PubChem (CID 24820095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).