2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide

C8H13N3OS — CID 86096848

IUPAC2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide
SMILESCc1csc(C)c1N(N)C(=O)CN
InChIInChI=1S/C8H13N3OS/c1-5-4-13-6(2)8(5)11(10)7(12)3-9/h4H,3,9-10H2,1-2H3
InChIKeyMQQKIUDXUNXMFP-UHFFFAOYSA-N
MW199.28 g/mol
LogP0.53
Rot. Bonds2

About 2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide

2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide (PubChem CID 86096848) has the molecular formula C8H13N3OS and a molecular weight of 199.28 g/mol. Its IUPAC name is 2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide.

Molecular Properties

Compound Name2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide
PubChem CID86096848
Molecular FormulaC8H13N3OS
Molecular Weight199.28 g/mol
Exact Mass199.08
IUPAC Name2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide
SMILESCc1csc(C)c1N(N)C(=O)CN
InChIInChI=1S/C8H13N3OS/c1-5-4-13-6(2)8(5)11(10)7(12)3-9/h4H,3,9-10H2,1-2H3
InChIKeyMQQKIUDXUNXMFP-UHFFFAOYSA-N
XLogP0.53
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 50.53
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

methyl (2S)-2-[(2,4-dimethylthiophen-3-yl)-(2-hydroxyacetyl)amino]propanoate
CID 22827701
N-(2,4-dimethylthiophen-3-yl)-N-(1-methoxypropan-2-yl)propanamide
CID 137381087
N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide
CID 70146312
2-amino-N-phenylacetohydrazide
CID 70067236
2-[(2,4-dimethylthiophen-3-yl)-(1-methoxypropan-2-yl)amino]-2-oxoethanesulfonic acid
CID 6426850
2-amino-N-methyl-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 60718810
ethyl 4-ethyl-5-methylthiophene-3-carboxylate
CID 114748154
ethyl 3-iodo-4-methylthiophene-2-carboxylate
CID 131132175
2-[2-[(2,4-dimethylthiophen-3-yl)-(1-methoxypropan-2-yl)amino]-2-oxoethyl]sulfinylacetic acid
CID 139597015
N-(2,4-dimethylthiophen-3-yl)acetamide
CID 71412387
2-amino-N-methyl-N-(2,4,5-trimethylphenyl)acetamide
CID 82492268
2-amino-N-methyl-N-(2-methylphenyl)acetamide
CID 28794373

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide?
The IUPAC name of 2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide (CID 86096848) is 2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide.
What is the SMILES notation for 2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide?
The canonical SMILES for 2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide is Cc1csc(C)c1N(N)C(=O)CN.
What is the InChIKey of 2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide?
The InChIKey is MQQKIUDXUNXMFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3OS/c1-5-4-13-6(2)8(5)11(10)7(12)3-9/h4H,3,9-10H2,1-2H3.
What are the key properties of 2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide?
2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide has a molecular weight of 199.28 g/mol, XLogP of 0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,4-dimethylthiophen-3-yl)acetohydrazide is sourced from PubChem (CID 86096848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).