3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine

C14H18N4S — CID 106850370

IUPAC3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine
SMILESCSc1ccc(C(Cc2cccnc2N)NN)cc1
InChIInChI=1S/C14H18N4S/c1-19-12-6-4-10(5-7-12)13(18-16)9-11-3-2-8-17-14(11)15/h2-8,13,18H,9,16H2,1H3,(H2,15,17)
InChIKeyUTKAJSBNJFIKFK-UHFFFAOYSA-N
MW274.39 g/mol
LogP2.13
Rot. Bonds5

About 3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine

3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine (PubChem CID 106850370) has the molecular formula C14H18N4S and a molecular weight of 274.39 g/mol. Its IUPAC name is 3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine
PubChem CID106850370
Molecular FormulaC14H18N4S
Molecular Weight274.39 g/mol
Exact Mass274.13
IUPAC Name3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine
SMILESCSc1ccc(C(Cc2cccnc2N)NN)cc1
InChIInChI=1S/C14H18N4S/c1-19-12-6-4-10(5-7-12)13(18-16)9-11-3-2-8-17-14(11)15/h2-8,13,18H,9,16H2,1H3,(H2,15,17)
InChIKeyUTKAJSBNJFIKFK-UHFFFAOYSA-N
XLogP2.13
TPSA76.96 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 52.13
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-[2-(4-chlorophenyl)-2-hydrazinylethyl]pyridin-2-amine
CID 105193448
3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-2-amine
CID 105190972
3-[2-(3-chloro-2-pyridinyl)-2-hydrazinylethyl]pyridin-2-amine
CID 103445799
3-[2-hydrazinyl-2-(1,3-thiazol-4-yl)ethyl]pyridin-2-amine
CID 105254539
3-(2-hydrazinyl-3-propan-2-ylsulfanylpropyl)pyridin-2-amine
CID 105226241
3-[2-(5-chloro-2-pyridinyl)-2-hydrazinylethyl]pyridin-2-amine
CID 105251608
3-(2-hydrazinyl-2-isoquinolin-1-ylethyl)pyridin-2-amine
CID 105220678
3-(2-methylpropyl)pyridin-2-amine
CID 20771927
[2-(4-bromophenyl)-1-(4-methylsulfanylphenyl)ethyl]hydrazine
CID 105284436
3-[2-(3-bromo-4-fluorophenyl)-2-(methylamino)ethyl]pyridin-2-amine
CID 82809316
3-[2-(3-bromo-4-chlorophenyl)-2-(methylamino)ethyl]pyridin-2-amine
CID 115567050
1-(2-amino-3-pyridinyl)-3-(4-fluorophenyl)sulfanylpropan-2-ol
CID 66070761

Frequently Asked Questions

What is the IUPAC name of 3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine?
The IUPAC name of 3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine (CID 106850370) is 3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine.
What is the SMILES notation for 3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine?
The canonical SMILES for 3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine is CSc1ccc(C(Cc2cccnc2N)NN)cc1.
What is the InChIKey of 3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine?
The InChIKey is UTKAJSBNJFIKFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4S/c1-19-12-6-4-10(5-7-12)13(18-16)9-11-3-2-8-17-14(11)15/h2-8,13,18H,9,16H2,1H3,(H2,15,17).
What are the key properties of 3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine?
3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine has a molecular weight of 274.39 g/mol, XLogP of 2.13, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-hydrazinyl-2-(4-methylsulfanylphenyl)ethyl]pyridin-2-amine is sourced from PubChem (CID 106850370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).