2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide

C8H11ClN2OS — CID 116845748

IUPAC2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide
SMILESCC(C(=O)N(C)N)c1ccc(Cl)s1
InChIInChI=1S/C8H11ClN2OS/c1-5(8(12)11(2)10)6-3-4-7(9)13-6/h3-5H,10H2,1-2H3
InChIKeyZAOHUOUNWSJXNS-UHFFFAOYSA-N
MW218.71 g/mol
LogP1.84
Rot. Bonds2

About 2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide

2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide (PubChem CID 116845748) has the molecular formula C8H11ClN2OS and a molecular weight of 218.71 g/mol. Its IUPAC name is 2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide.

Molecular Properties

Compound Name2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide
PubChem CID116845748
Molecular FormulaC8H11ClN2OS
Molecular Weight218.71 g/mol
Exact Mass218.03
IUPAC Name2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide
SMILESCC(C(=O)N(C)N)c1ccc(Cl)s1
InChIInChI=1S/C8H11ClN2OS/c1-5(8(12)11(2)10)6-3-4-7(9)13-6/h3-5H,10H2,1-2H3
InChIKeyZAOHUOUNWSJXNS-UHFFFAOYSA-N
XLogP1.84
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.71
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

N-(1-aminopropan-2-yl)-2-(5-chlorothiophen-2-yl)-N-methylpropanamide
CID 119582214
2-(5-chlorothiophen-2-yl)-N-methyl-N-propan-2-ylsulfonylpropanamide
CID 71859613
(2R)-2-(5-chlorothiophen-2-yl)-N-methyl-N-propan-2-ylsulfonylpropanamide
CID 97018750
2-(5-chlorothiophen-2-yl)-N-methyl-N-(2-methylpyrazol-3-yl)propanamide
CID 71861310
2-[2-(5-chlorothiophen-2-yl)propanoyl-cyclopropylamino]acetic acid
CID 120517629
N-(3-aminopropyl)-2-(5-chlorothiophen-2-yl)propanamide
CID 119405790
2-amino-2-(5-chlorothiophen-2-yl)-N',N'-dimethylacetohydrazide
CID 116849788
2-(5-chlorothiophen-2-yl)-N-[(3-hydroxy-4-methoxyphenyl)methyl]-N-methylpropanamide
CID 71914600
N-(1,3-benzoxazol-2-ylmethyl)-2-(5-chlorothiophen-2-yl)-N-methylpropanamide
CID 75385673
N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide
CID 131207227
methyl (2S)-2-amino-2-(5-chlorothiophen-2-yl)acetate
CID 12968026
N-(2-amino-2-ethylbutyl)-2-(5-chlorothiophen-2-yl)propanamide;hydrochloride
CID 119640650

Frequently Asked Questions

What is the IUPAC name of 2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide?
The IUPAC name of 2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide (CID 116845748) is 2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide.
What is the SMILES notation for 2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide?
The canonical SMILES for 2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide is CC(C(=O)N(C)N)c1ccc(Cl)s1.
What is the InChIKey of 2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide?
The InChIKey is ZAOHUOUNWSJXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClN2OS/c1-5(8(12)11(2)10)6-3-4-7(9)13-6/h3-5H,10H2,1-2H3.
What are the key properties of 2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide?
2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide has a molecular weight of 218.71 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chlorothiophen-2-yl)-N-methylpropanehydrazide is sourced from PubChem (CID 116845748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).