2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine

C13H17N3OS — CID 53272462

IUPAC2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine
SMILESCOc1ccc(-c2cnc(CNN(C)C)s2)cc1
InChIInChI=1S/C13H17N3OS/c1-16(2)15-9-13-14-8-12(18-13)10-4-6-11(17-3)7-5-10/h4-8,15H,9H2,1-3H3
InChIKeyXOQMJTQOBCHRMO-UHFFFAOYSA-N
MW263.37 g/mol
LogP2.38
Rot. Bonds5

About 2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine

2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine (PubChem CID 53272462) has the molecular formula C13H17N3OS and a molecular weight of 263.37 g/mol. Its IUPAC name is 2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine.

Molecular Properties

Compound Name2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine
PubChem CID53272462
Molecular FormulaC13H17N3OS
Molecular Weight263.37 g/mol
Exact Mass263.11
IUPAC Name2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine
SMILESCOc1ccc(-c2cnc(CNN(C)C)s2)cc1
InChIInChI=1S/C13H17N3OS/c1-16(2)15-9-13-14-8-12(18-13)10-4-6-11(17-3)7-5-10/h4-8,15H,9H2,1-3H3
InChIKeyXOQMJTQOBCHRMO-UHFFFAOYSA-N
XLogP2.38
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.37
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 46785062
N-[[5-(4-bromophenyl)-1,3-thiazol-2-yl]methyl]-2-(4-methoxyphenyl)ethanamine
CID 53272874
1,1-dimethyl-2-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]hydrazine
CID 53272757
N-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1-thiophen-2-ylmethanamine
CID 53272360
2-(4-methoxyphenyl)-N-[(5-phenyl-1,3-thiazol-2-yl)methyl]ethanamine
CID 53271692
1-[5-(3-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 46785061
N-ethyl-5-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 116811972
2-chloro-5-[4-(4-methoxyphenyl)phenyl]-1,3-thiazole
CID 21408740
N-[[5-(3-methoxyphenyl)-1,3-thiazol-2-yl]methyl]cyclopentanamine
CID 53272487
N-[[5-(3-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1-phenylmethanamine
CID 53272362
5-(4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole
CID 14531637
1-[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethanone
CID 166892998

Frequently Asked Questions

What is the IUPAC name of 2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine?
The IUPAC name of 2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine (CID 53272462) is 2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine.
What is the SMILES notation for 2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine?
The canonical SMILES for 2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine is COc1ccc(-c2cnc(CNN(C)C)s2)cc1.
What is the InChIKey of 2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine?
The InChIKey is XOQMJTQOBCHRMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3OS/c1-16(2)15-9-13-14-8-12(18-13)10-4-6-11(17-3)7-5-10/h4-8,15H,9H2,1-3H3.
What are the key properties of 2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine?
2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine has a molecular weight of 263.37 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine is sourced from PubChem (CID 53272462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).