4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide

C15H18N2O3S — CID 107710081

IUPAC4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide
SMILESCc1sc(C(=O)NN)cc1COc1ccc(CCO)cc1
InChIInChI=1S/C15H18N2O3S/c1-10-12(8-14(21-10)15(19)17-16)9-20-13-4-2-11(3-5-13)6-7-18/h2-5,8,18H,6-7,9,16H2,1H3,(H,17,19)
InChIKeyNLOZSAGEWWMHCV-UHFFFAOYSA-N
MW306.39 g/mol
LogP1.77
Rot. Bonds6

About 4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide

4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide (PubChem CID 107710081) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is 4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide.

Molecular Properties

Compound Name4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide
PubChem CID107710081
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC Name4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide
SMILESCc1sc(C(=O)NN)cc1COc1ccc(CCO)cc1
InChIInChI=1S/C15H18N2O3S/c1-10-12(8-14(21-10)15(19)17-16)9-20-13-4-2-11(3-5-13)6-7-18/h2-5,8,18H,6-7,9,16H2,1H3,(H,17,19)
InChIKeyNLOZSAGEWWMHCV-UHFFFAOYSA-N
XLogP1.77
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 51.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide 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-[(3-bromophenoxy)methyl]-5-methylthiophene-2-carbohydrazide
CID 80733439
4-[(2-fluorophenoxy)methyl]-5-methylthiophene-2-carbohydrazide
CID 80733698
4-[(5-fluoro-2-methylphenoxy)methyl]-5-methylthiophene-2-carbohydrazide
CID 102987730
4-[(2-cyanophenoxy)methyl]-5-methylthiophene-2-carbohydrazide
CID 80734004
5-[[4-(2-methoxyethyl)phenoxy]methyl]thiophene-2-carbohydrazide
CID 63575058
5-methyl-4-(oxetan-3-yloxymethyl)thiophene-2-carbohydrazide
CID 102608464
5-[[4-(2-oxopropyl)phenoxy]methyl]thiophene-2-carbohydrazide
CID 115496156
N'-(4-ethoxybenzoyl)-5-methyl-4-propylthiophene-2-carbohydrazide
CID 27619786
4-[(3,5-dimethylcyclohexyl)oxymethyl]-5-methylthiophene-2-carbohydrazide
CID 80733862
3-amino-4-[[4-(2-hydroxyethyl)phenoxy]methyl]benzamide
CID 107708557
methyl 4-chloro-2-[[4-(2-hydroxyethyl)phenoxy]methyl]benzoate
CID 58820411
ethyl 3-[4-(2-hydroxyethyl)phenoxy]propanoate
CID 86193635

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide?
The IUPAC name of 4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide (CID 107710081) is 4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide.
What is the SMILES notation for 4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide?
The canonical SMILES for 4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide is Cc1sc(C(=O)NN)cc1COc1ccc(CCO)cc1.
What is the InChIKey of 4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide?
The InChIKey is NLOZSAGEWWMHCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S/c1-10-12(8-14(21-10)15(19)17-16)9-20-13-4-2-11(3-5-13)6-7-18/h2-5,8,18H,6-7,9,16H2,1H3,(H,17,19).
What are the key properties of 4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide?
4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide has a molecular weight of 306.39 g/mol, XLogP of 1.77, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(2-hydroxyethyl)phenoxy]methyl]-5-methylthiophene-2-carbohydrazide is sourced from PubChem (CID 107710081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).