5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide

C10H15N3OS — CID 63573825

IUPAC5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide
SMILESCN(Cc1ccc(C(=O)NN)s1)C1CC1
InChIInChI=1S/C10H15N3OS/c1-13(7-2-3-7)6-8-4-5-9(15-8)10(14)12-11/h4-5,7H,2-3,6,11H2,1H3,(H,12,14)
InChIKeyLFLUHBMVLQLXAM-UHFFFAOYSA-N
MW225.32 g/mol
LogP0.95
Rot. Bonds4

About 5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide

5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide (PubChem CID 63573825) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide.

Molecular Properties

Compound Name5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide
PubChem CID63573825
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide
SMILESCN(Cc1ccc(C(=O)NN)s1)C1CC1
InChIInChI=1S/C10H15N3OS/c1-13(7-2-3-7)6-8-4-5-9(15-8)10(14)12-11/h4-5,7H,2-3,6,11H2,1H3,(H,12,14)
InChIKeyLFLUHBMVLQLXAM-UHFFFAOYSA-N
XLogP0.95
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

5-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]thiophene-2-carbohydrazide
CID 63572100
5-[[cyclohexyl(methyl)amino]methyl]thiophene-2-carboxylic acid
CID 63377803
methyl 5-[[[4-(hydroxymethyl)cyclohexyl]-methylamino]methyl]thiophene-2-carboxylate
CID 75434428
5-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]thiophene-2-carbohydrazide
CID 63578588
5-[(dipropylamino)methyl]thiophene-2-carbohydrazide
CID 63570424
5-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]thiophene-2-carbohydrazide
CID 63585226
5-[[2-(dimethylamino)ethyl-(2-methylpropyl)amino]methyl]thiophene-2-carbohydrazide
CID 63583743
N-ethyl-2-[[5-(hydrazinecarbonyl)thiophen-2-yl]methyl-methylamino]acetamide
CID 63583466
5-[[2-cyanopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide
CID 55212482
5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]thiophene-2-carbohydrazide
CID 81067684
N-methyl-N-[(5-methylthiophen-2-yl)methyl]cyclopropanamine
CID 130734905
5-[(2,6-dimethylpiperidin-1-yl)methyl]thiophene-2-carbohydrazide
CID 55214398

Frequently Asked Questions

What is the IUPAC name of 5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide?
The IUPAC name of 5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide (CID 63573825) is 5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide.
What is the SMILES notation for 5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide?
The canonical SMILES for 5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide is CN(Cc1ccc(C(=O)NN)s1)C1CC1.
What is the InChIKey of 5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide?
The InChIKey is LFLUHBMVLQLXAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-13(7-2-3-7)6-8-4-5-9(15-8)10(14)12-11/h4-5,7H,2-3,6,11H2,1H3,(H,12,14).
What are the key properties of 5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide?
5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide has a molecular weight of 225.32 g/mol, XLogP of 0.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[cyclopropyl(methyl)amino]methyl]thiophene-2-carbohydrazide is sourced from PubChem (CID 63573825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).