N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide

C14H15N3O3S — CID 108529987

IUPACN'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)Nc2nc(C)c(C)s2)c(O)c1
InChIInChI=1S/C14H15N3O3S/c1-7-4-5-10(11(18)6-7)16-12(19)13(20)17-14-15-8(2)9(3)21-14/h4-6,18H,1-3H3,(H,16,19)(H,15,17,20)
InChIKeyAUSAMGNSAMJYTK-UHFFFAOYSA-N
MW305.36 g/mol
LogP2.35
Rot. Bonds2

About N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide

N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide (PubChem CID 108529987) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide.

Molecular Properties

Compound NameN'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide
PubChem CID108529987
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC NameN'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)Nc2nc(C)c(C)s2)c(O)c1
InChIInChI=1S/C14H15N3O3S/c1-7-4-5-10(11(18)6-7)16-12(19)13(20)17-14-15-8(2)9(3)21-14/h4-6,18H,1-3H3,(H,16,19)(H,15,17,20)
InChIKeyAUSAMGNSAMJYTK-UHFFFAOYSA-N
XLogP2.35
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 52.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-(2,5-dimethylphenyl)-N'-(4,5-dimethyl-1,3-thiazol-2-yl)oxamide
CID 108529959
4-[(4,5-dimethyl-1,3-thiazol-2-yl)carbamoylamino]-3-hydroxybenzoic acid
CID 61465540
N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-methoxy-4-nitrophenyl)oxamide
CID 108513016
(2-hydroxy-4-methylphenyl)carbamic acid
CID 150954489
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-fluoro-4-methylbenzamide
CID 79769818
N'-(2-hydroxy-4-methylphenyl)-N-(4-iodophenyl)oxamide
CID 108532032
N-(3,4-dimethylphenyl)-N'-(2-hydroxy-4-methylphenyl)oxamide
CID 108523165
N-(2-hydroxy-4-methylphenyl)-N'-(2,4,4-trimethylpentan-2-yl)oxamide
CID 108526288
methyl N-(2-hydroxy-4-methylphenyl)carbamate
CID 61269197
N-(2,4-dimethylphenyl)-2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-4,6-dimethylpyrimidine-5-carboxamide
CID 16584145
N-(4,5-dimethyl-1,3-thiazol-2-yl)-4-(methylamino)benzamide
CID 55046054
N'-(3-acetamidophenyl)-N-(2-hydroxy-4-methylphenyl)oxamide
CID 108526616

Frequently Asked Questions

What is the IUPAC name of N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide?
The IUPAC name of N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide (CID 108529987) is N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide.
What is the SMILES notation for N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide?
The canonical SMILES for N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide is Cc1ccc(NC(=O)C(=O)Nc2nc(C)c(C)s2)c(O)c1.
What is the InChIKey of N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide?
The InChIKey is AUSAMGNSAMJYTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-7-4-5-10(11(18)6-7)16-12(19)13(20)17-14-15-8(2)9(3)21-14/h4-6,18H,1-3H3,(H,16,19)(H,15,17,20).
What are the key properties of N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide?
N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide has a molecular weight of 305.36 g/mol, XLogP of 2.35, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)oxamide is sourced from PubChem (CID 108529987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).