(3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone

C20H24N2O3S — CID 56897529

IUPAC(3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone
SMILESCCCc1nc(C(=O)N2CCCC(C(=O)c3cccc(OC)c3)C2)cs1
InChIInChI=1S/C20H24N2O3S/c1-3-6-18-21-17(13-26-18)20(24)22-10-5-8-15(12-22)19(23)14-7-4-9-16(11-14)25-2/h4,7,9,11,13,15H,3,5-6,8,10,12H2,1-2H3
InChIKeyLARCVTOVLDKBCD-UHFFFAOYSA-N
MW372.49 g/mol
LogP3.84
Rot. Bonds6

About (3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone

(3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone (PubChem CID 56897529) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is (3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone.

Molecular Properties

Compound Name(3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone
PubChem CID56897529
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC Name(3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone
SMILESCCCc1nc(C(=O)N2CCCC(C(=O)c3cccc(OC)c3)C2)cs1
InChIInChI=1S/C20H24N2O3S/c1-3-6-18-21-17(13-26-18)20(24)22-10-5-8-15(12-22)19(23)14-7-4-9-16(11-14)25-2/h4,7,9,11,13,15H,3,5-6,8,10,12H2,1-2H3
InChIKeyLARCVTOVLDKBCD-UHFFFAOYSA-N
XLogP3.84
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]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

(3-methoxypiperidin-1-yl)-(2-propyl-1,3-thiazol-4-yl)methanone
CID 72865941
[4-[2-(2-aminoethyl)-1,3-thiazole-4-carbonyl]piperazin-1-yl]-(3-methoxyphenyl)methanone
CID 120622878
[2-(3-methoxyphenyl)azetidin-1-yl]-(2-propyl-1,3-thiazol-4-yl)methanone
CID 74243587
[1-(3-methoxybenzoyl)piperidin-3-yl]-(4-methylphenyl)methanone
CID 110394605
(3-methoxyphenyl)-[(3S)-1-(1-oxidopyridin-1-ium-4-carbonyl)piperidin-3-yl]methanone
CID 42151891
[(3R)-1-(2-benzyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(2-methoxyphenyl)methanone
CID 42154386
[1-(2-benzyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]-(2-methoxyphenyl)methanone
CID 45171795
(3-methoxyphenyl)-[4-[2-(2-methylpropyl)-1,3-thiazole-4-carbonyl]piperazin-1-yl]methanone
CID 136579606
ethyl 1-[2-[(3-fluorophenoxy)methyl]-1,3-thiazole-4-carbonyl]piperidine-3-carboxylate
CID 46003385
[1-[2-(aminomethyl)-1,3-thiazole-4-carbonyl]piperidin-3-yl]-(4-fluorophenyl)methanone
CID 119798418
(3-methoxyphenyl)-(1-methylpiperidin-3-yl)methanone
CID 82389965
(6-methoxynaphthalen-2-yl)-[1-(1,3-thiazole-5-carbonyl)piperidin-3-yl]methanone
CID 24791502

Frequently Asked Questions

What is the IUPAC name of (3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone?
The IUPAC name of (3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone (CID 56897529) is (3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone.
What is the SMILES notation for (3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone?
The canonical SMILES for (3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone is CCCc1nc(C(=O)N2CCCC(C(=O)c3cccc(OC)c3)C2)cs1.
What is the InChIKey of (3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone?
The InChIKey is LARCVTOVLDKBCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-3-6-18-21-17(13-26-18)20(24)22-10-5-8-15(12-22)19(23)14-7-4-9-16(11-14)25-2/h4,7,9,11,13,15H,3,5-6,8,10,12H2,1-2H3.
What are the key properties of (3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone?
(3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone has a molecular weight of 372.49 g/mol, XLogP of 3.84, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxyphenyl)-[1-(2-propyl-1,3-thiazole-4-carbonyl)piperidin-3-yl]methanone is sourced from PubChem (CID 56897529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).