N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide

C11H18N4O2S — CID 63583466

IUPACN-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide
SMILESCCNC(=O)CN(C)Cc1ccc(C(=O)NN)s1
InChIInChI=1S/C11H18N4O2S/c1-3-13-10(16)7-15(2)6-8-4-5-9(18-8)11(17)14-12/h4-5H,3,6-7,12H2,1-2H3,(H,13,16)(H,14,17)
InChIKeySYWMSSCVCWDLKD-UHFFFAOYSA-N
MW270.36 g/mol
LogP-0.08
Rot. Bonds6

About N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide

N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide (PubChem CID 63583466) has the molecular formula C11H18N4O2S and a molecular weight of 270.36 g/mol. Its IUPAC name is N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide
PubChem CID63583466
Molecular FormulaC11H18N4O2S
Molecular Weight270.36 g/mol
Exact Mass270.12
IUPAC NameN-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide
SMILESCCNC(=O)CN(C)Cc1ccc(C(=O)NN)s1
InChIInChI=1S/C11H18N4O2S/c1-3-13-10(16)7-15(2)6-8-4-5-9(18-8)11(17)14-12/h4-5H,3,6-7,12H2,1-2H3,(H,13,16)(H,14,17)
InChIKeySYWMSSCVCWDLKD-UHFFFAOYSA-N
XLogP-0.08
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 5-0.08
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'}

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Related Compounds

2-[(5-bromothiophen-2-yl)methyl-methylamino]-N-ethylacetamide
CID 60670553
5-[(dipropylamino)methyl]thiophene-2-carbohydrazide
CID 63570424
5-[[2-cyanopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide
CID 55212482
5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]thiophene-2-carbohydrazide
CID 81067684
5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide
CID 63573825
5-[[methyl(pyridin-2-ylmethyl)amino]methyl]thiophene-2-carbohydrazide
CID 63571803
5-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]thiophene-2-carbohydrazide
CID 63572100
5-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]thiophene-2-carbohydrazide
CID 63585226
5-[[methyl(2-pyridin-2-ylethyl)amino]methyl]thiophene-2-carbohydrazide
CID 63573242
5-[[3-hydroxypropyl(propan-2-yl)amino]methyl]thiophene-2-carbohydrazide
CID 63578253
5-[[2-(dimethylamino)ethyl-(2-methylpropyl)amino]methyl]thiophene-2-carbohydrazide
CID 63583743
5-[(2-methoxy-N-methylanilino)methyl]thiophene-2-carbohydrazide
CID 63585839

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide?
The IUPAC name of N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide (CID 63583466) is N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide.
What is the SMILES notation for N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide?
The canonical SMILES for N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide is CCNC(=O)CN(C)Cc1ccc(C(=O)NN)s1.
What is the InChIKey of N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide?
The InChIKey is SYWMSSCVCWDLKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2S/c1-3-13-10(16)7-15(2)6-8-4-5-9(18-8)11(17)14-12/h4-5H,3,6-7,12H2,1-2H3,(H,13,16)(H,14,17).
What are the key properties of N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide?
N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide has a molecular weight of 270.36 g/mol, XLogP of -0.08, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide is sourced from PubChem (CID 63583466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).