3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine

C11H11Cl3N4S — CID 102761773

IUPAC3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine
SMILESCC(Nc1nc(NN)c(Cl)cc1Cl)c1ccc(Cl)s1
InChIInChI=1S/C11H11Cl3N4S/c1-5(8-2-3-9(14)19-8)16-10-6(12)4-7(13)11(17-10)18-15/h2-5H,15H2,1H3,(H2,16,17,18)
InChIKeyVDBMFUSESUXQEZ-UHFFFAOYSA-N
MW337.66 g/mol
LogP4.56
Rot. Bonds4

About 3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine

3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine (PubChem CID 102761773) has the molecular formula C11H11Cl3N4S and a molecular weight of 337.66 g/mol. Its IUPAC name is 3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine
PubChem CID102761773
Molecular FormulaC11H11Cl3N4S
Molecular Weight337.66 g/mol
Exact Mass335.98
IUPAC Name3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine
SMILESCC(Nc1nc(NN)c(Cl)cc1Cl)c1ccc(Cl)s1
InChIInChI=1S/C11H11Cl3N4S/c1-5(8-2-3-9(14)19-8)16-10-6(12)4-7(13)11(17-10)18-15/h2-5H,15H2,1H3,(H2,16,17,18)
InChIKeyVDBMFUSESUXQEZ-UHFFFAOYSA-N
XLogP4.56
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.66
LogP ≤ 54.56
H-Bond Donors ≤ 53
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

3,5-dichloro-6-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2,6-diamine
CID 102756938
3,5-dichloro-N-[1-(4-fluorophenyl)ethyl]-6-hydrazinylpyridin-2-amine
CID 102761792
N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80964990
N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyrimidin-4-amine
CID 80897987
3-chloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-5-(trifluoromethyl)pyridin-2-amine
CID 63541342
3,5-dichloro-N-[1-(3-fluorophenyl)ethyl]-6-hydrazinylpyridin-2-amine
CID 102761800
4-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-N,2,5-trimethylpyrimidine-4,6-diamine
CID 80803114
5-chloro-4-N-[1-(5-chlorothiophen-2-yl)ethyl]-2-N-propylpyrimidine-2,4-diamine
CID 80804211
3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]aniline
CID 43438966
4-N-[1-(5-chlorothiophen-2-yl)ethyl]-2-cyclopropylpyrimidine-4,6-diamine
CID 80961862
3,5-dichloro-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-6-hydrazinylpyridin-2-amine
CID 102762257
1-(5-chlorothiophen-2-yl)-N-[1-(5-chlorothiophen-2-yl)ethyl]ethanamine
CID 43692517

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine (CID 102761773) is 3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine is CC(Nc1nc(NN)c(Cl)cc1Cl)c1ccc(Cl)s1.
What is the InChIKey of 3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine?
The InChIKey is VDBMFUSESUXQEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl3N4S/c1-5(8-2-3-9(14)19-8)16-10-6(12)4-7(13)11(17-10)18-15/h2-5H,15H2,1H3,(H2,16,17,18).
What are the key properties of 3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine?
3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine has a molecular weight of 337.66 g/mol, XLogP of 4.56, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[1-(5-chlorothiophen-2-yl)ethyl]-6-hydrazinylpyridin-2-amine is sourced from PubChem (CID 102761773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).