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

C16H20ClN3O3S — CID 119693768

IUPACN-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride
SMILESCOc1ccc(C)cc1-c1csc(NC(=O)C2COCCN2)n1.Cl
InChIInChI=1S/C16H19N3O3S.ClH/c1-10-3-4-14(21-2)11(7-10)13-9-23-16(18-13)19-15(20)12-8-22-6-5-17-12;/h3-4,7,9,12,17H,5-6,8H2,1-2H3,(H,18,19,20);1H
InChIKeySLRJRRUJCBRANV-UHFFFAOYSA-N
MW369.87 g/mol
LogP2.48
Rot. Bonds4

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

N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride (PubChem CID 119693768) has the molecular formula C16H20ClN3O3S and a molecular weight of 369.87 g/mol. Its IUPAC name is N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride
PubChem CID119693768
Molecular FormulaC16H20ClN3O3S
Molecular Weight369.87 g/mol
Exact Mass369.09
IUPAC NameN-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride
SMILESCOc1ccc(C)cc1-c1csc(NC(=O)C2COCCN2)n1.Cl
InChIInChI=1S/C16H19N3O3S.ClH/c1-10-3-4-14(21-2)11(7-10)13-9-23-16(18-13)19-15(20)12-8-22-6-5-17-12;/h3-4,7,9,12,17H,5-6,8H2,1-2H3,(H,18,19,20);1H
InChIKeySLRJRRUJCBRANV-UHFFFAOYSA-N
XLogP2.48
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.87
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride
CID 119689444
N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride
CID 119697771
N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 119673632
9-amino-N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120984295
1-amino-N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]cyclopentane-1-carboxamide;hydrochloride
CID 119273536
methyl 4-[[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]carbamoyl]benzoate
CID 26723703
N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 112797570
N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]-2,4,5-trimethylfuran-3-carboxamide
CID 35889009
N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 17417503
N-(4-methoxy-2,3-dimethylphenyl)morpholine-3-carboxamide
CID 115177555
N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]-2-thiophen-2-ylacetamide
CID 26723539
N-(2-methoxy-4,6-dimethylphenyl)morpholine-3-carboxamide
CID 115177560

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride (CID 119693768) is N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride is COc1ccc(C)cc1-c1csc(NC(=O)C2COCCN2)n1.Cl.
What is the InChIKey of N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride?
The InChIKey is SLRJRRUJCBRANV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3S.ClH/c1-10-3-4-14(21-2)11(7-10)13-9-23-16(18-13)19-15(20)12-8-22-6-5-17-12;/h3-4,7,9,12,17H,5-6,8H2,1-2H3,(H,18,19,20);1H.
What are the key properties of N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride?
N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride has a molecular weight of 369.87 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119693768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).