4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine

C9H13N5S — CID 105231201

IUPAC4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine
SMILESCc1ccsc1C(NN)c1cn[nH]c1N
InChIInChI=1S/C9H13N5S/c1-5-2-3-15-8(5)7(13-11)6-4-12-14-9(6)10/h2-4,7,13H,11H2,1H3,(H3,10,12,14)
InChIKeyUHCDZYXUJLDXGT-UHFFFAOYSA-N
MW223.31 g/mol
LogP0.91
Rot. Bonds3

About 4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine

4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine (PubChem CID 105231201) has the molecular formula C9H13N5S and a molecular weight of 223.31 g/mol. Its IUPAC name is 4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine
PubChem CID105231201
Molecular FormulaC9H13N5S
Molecular Weight223.31 g/mol
Exact Mass223.09
IUPAC Name4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine
SMILESCc1ccsc1C(NN)c1cn[nH]c1N
InChIInChI=1S/C9H13N5S/c1-5-2-3-15-8(5)7(13-11)6-4-12-14-9(6)10/h2-4,7,13H,11H2,1H3,(H3,10,12,14)
InChIKeyUHCDZYXUJLDXGT-UHFFFAOYSA-N
XLogP0.91
TPSA92.75 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.31
LogP ≤ 50.91
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[(3-fluoro-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105258625
[(3-bromo-2-methylphenyl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105322462
[(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105322474
[(2-methylfuran-3-yl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105269085
4-[(4-fluorophenyl)-hydrazinylmethyl]-1H-pyrazol-5-amine
CID 105231191
[(2-methylsulfanylphenyl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105322402
4-[(4-ethylphenyl)-hydrazinylmethyl]-1H-pyrazol-5-amine
CID 105231284
[1-benzothiophen-7-yl-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105327742
[(3,5-dimethyl-2-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105266430
[(2,4-dichlorophenyl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105322333
[(3-methylthiophen-2-yl)-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 105208141
[(4-bromothiophen-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105222526

Frequently Asked Questions

What is the IUPAC name of 4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine?
The IUPAC name of 4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine (CID 105231201) is 4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine.
What is the SMILES notation for 4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine?
The canonical SMILES for 4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine is Cc1ccsc1C(NN)c1cn[nH]c1N.
What is the InChIKey of 4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine?
The InChIKey is UHCDZYXUJLDXGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5S/c1-5-2-3-15-8(5)7(13-11)6-4-12-14-9(6)10/h2-4,7,13H,11H2,1H3,(H3,10,12,14).
What are the key properties of 4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine?
4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine has a molecular weight of 223.31 g/mol, XLogP of 0.91, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[hydrazinyl-(3-methylthiophen-2-yl)methyl]-1H-pyrazol-5-amine is sourced from PubChem (CID 105231201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).