4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride

C18H24ClN3O2S — CID 119681507

IUPAC4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride
SMILESCOC1(C(=O)Nc2nc(-c3ccc(C)cc3)c(C)s2)CCNCC1.Cl
InChIInChI=1S/C18H23N3O2S.ClH/c1-12-4-6-14(7-5-12)15-13(2)24-17(20-15)21-16(22)18(23-3)8-10-19-11-9-18;/h4-7,19H,8-11H2,1-3H3,(H,20,21,22);1H
InChIKeyICBVAAQHSRAHQL-UHFFFAOYSA-N
MW381.93 g/mol
LogP3.56
Rot. Bonds4

About 4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride

4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride (PubChem CID 119681507) has the molecular formula C18H24ClN3O2S and a molecular weight of 381.93 g/mol. Its IUPAC name is 4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride
PubChem CID119681507
Molecular FormulaC18H24ClN3O2S
Molecular Weight381.93 g/mol
Exact Mass381.13
IUPAC Name4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride
SMILESCOC1(C(=O)Nc2nc(-c3ccc(C)cc3)c(C)s2)CCNCC1.Cl
InChIInChI=1S/C18H23N3O2S.ClH/c1-12-4-6-14(7-5-12)15-13(2)24-17(20-15)21-16(22)18(23-3)8-10-19-11-9-18;/h4-7,19H,8-11H2,1-3H3,(H,20,21,22);1H
InChIKeyICBVAAQHSRAHQL-UHFFFAOYSA-N
XLogP3.56
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.93
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride 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

4-methoxy-N-(4-methylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119670964
4-methoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide;hydrochloride
CID 119679205
1-amino-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]cyclopropane-1-carboxamide;hydrochloride
CID 119677238
N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]adamantane-1-carboxamide;hydrochloride
CID 2894436
4-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)piperidine-4-carboxamide;hydrochloride
CID 119670233
N-[4-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1,3-thiazol-2-yl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120630964
1-amino-N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]cyclopentane-1-carboxamide;hydrochloride
CID 119266987
N-[5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 120589563
N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride
CID 119266983
4-methoxy-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]piperidine-4-carboxamide
CID 119694020
N-[5-[(3-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 120589491
4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride
CID 119671002

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride?
The IUPAC name of 4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride (CID 119681507) is 4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for 4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for 4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride is COC1(C(=O)Nc2nc(-c3ccc(C)cc3)c(C)s2)CCNCC1.Cl.
What is the InChIKey of 4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride?
The InChIKey is ICBVAAQHSRAHQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2S.ClH/c1-12-4-6-14(7-5-12)15-13(2)24-17(20-15)21-16(22)18(23-3)8-10-19-11-9-18;/h4-7,19H,8-11H2,1-3H3,(H,20,21,22);1H.
What are the key properties of 4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride?
4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride has a molecular weight of 381.93 g/mol, XLogP of 3.56, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119681507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).