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

C12H21N5S — CID 106446527

IUPAC3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine
SMILESCN1CCSCC1C(Cc1cccnc1N)NN
InChIInChI=1S/C12H21N5S/c1-17-5-6-18-8-11(17)10(16-14)7-9-3-2-4-15-12(9)13/h2-4,10-11,16H,5-8,14H2,1H3,(H2,13,15)
InChIKeySZUSTFJUCNRWSH-UHFFFAOYSA-N
MW267.40 g/mol
LogP0.09
Rot. Bonds4

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

3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine (PubChem CID 106446527) has the molecular formula C12H21N5S and a molecular weight of 267.40 g/mol. Its IUPAC name is 3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine
PubChem CID106446527
Molecular FormulaC12H21N5S
Molecular Weight267.40 g/mol
Exact Mass267.15
IUPAC Name3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine
SMILESCN1CCSCC1C(Cc1cccnc1N)NN
InChIInChI=1S/C12H21N5S/c1-17-5-6-18-8-11(17)10(16-14)7-9-3-2-4-15-12(9)13/h2-4,10-11,16H,5-8,14H2,1H3,(H2,13,15)
InChIKeySZUSTFJUCNRWSH-UHFFFAOYSA-N
XLogP0.09
TPSA80.20 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.40
LogP ≤ 50.09
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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Frequently Asked Questions

What is the IUPAC name of 3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine?
The IUPAC name of 3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine (CID 106446527) is 3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine is CN1CCSCC1C(Cc1cccnc1N)NN.
What is the InChIKey of 3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine?
The InChIKey is SZUSTFJUCNRWSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5S/c1-17-5-6-18-8-11(17)10(16-14)7-9-3-2-4-15-12(9)13/h2-4,10-11,16H,5-8,14H2,1H3,(H2,13,15).
What are the key properties of 3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine?
3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine has a molecular weight of 267.40 g/mol, XLogP of 0.09, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 106446527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).