4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine

C10H14ClN5S — CID 105230944

IUPAC4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine
SMILESCn1ncc(C(Cc2ccc(Cl)s2)NN)c1N
InChIInChI=1S/C10H14ClN5S/c1-16-10(12)7(5-14-16)8(15-13)4-6-2-3-9(11)17-6/h2-3,5,8,15H,4,12-13H2,1H3
InChIKeyVYAKDHHOVKXQGW-UHFFFAOYSA-N
MW271.78 g/mol
LogP1.46
Rot. Bonds4

About 4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine

4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine (PubChem CID 105230944) has the molecular formula C10H14ClN5S and a molecular weight of 271.78 g/mol. Its IUPAC name is 4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine
PubChem CID105230944
Molecular FormulaC10H14ClN5S
Molecular Weight271.78 g/mol
Exact Mass271.07
IUPAC Name4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine
SMILESCn1ncc(C(Cc2ccc(Cl)s2)NN)c1N
InChIInChI=1S/C10H14ClN5S/c1-16-10(12)7(5-14-16)8(15-13)4-6-2-3-9(11)17-6/h2-3,5,8,15H,4,12-13H2,1H3
InChIKeyVYAKDHHOVKXQGW-UHFFFAOYSA-N
XLogP1.46
TPSA81.89 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.78
LogP ≤ 51.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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

4-[2-(3-chloro-2-fluorophenyl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine
CID 102867831
2-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]aniline
CID 105223951
4-[1-hydrazinyl-2-(1-methylpyrazol-3-yl)ethyl]-1-methylpyrazol-5-amine
CID 105230787
[2-(5-chlorothiophen-2-yl)-1-(4-methylthiophen-3-yl)ethyl]hydrazine
CID 105251917
[2-(5-chlorothiophen-2-yl)-1-(furan-3-yl)ethyl]hydrazine
CID 105221418
[2-(5-chlorothiophen-2-yl)-1-(2,3-dimethylphenyl)ethyl]hydrazine
CID 105295852
4-[2-(2-bromo-4-fluorophenyl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine
CID 105230777
4-[2-(3-bromophenyl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine
CID 105230843
4-(3-ethyl-1-hydrazinylpentyl)-1-methylpyrazol-5-amine
CID 105230973
[1-(5-chloro-2-pyridinyl)-2-(5-chlorothiophen-2-yl)ethyl]hydrazine
CID 105251592
[1-(4-chloro-2-fluorophenyl)-2-(5-chlorothiophen-2-yl)ethyl]hydrazine
CID 105217959
[2-(5-chlorothiophen-2-yl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
CID 105295997

Frequently Asked Questions

What is the IUPAC name of 4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine?
The IUPAC name of 4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine (CID 105230944) is 4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine?
The canonical SMILES for 4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine is Cn1ncc(C(Cc2ccc(Cl)s2)NN)c1N.
What is the InChIKey of 4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine?
The InChIKey is VYAKDHHOVKXQGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN5S/c1-16-10(12)7(5-14-16)8(15-13)4-6-2-3-9(11)17-6/h2-3,5,8,15H,4,12-13H2,1H3.
What are the key properties of 4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine?
4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine has a molecular weight of 271.78 g/mol, XLogP of 1.46, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(5-chlorothiophen-2-yl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine is sourced from PubChem (CID 105230944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).