2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine

C10H14N6S — CID 80917622

IUPAC2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
SMILESCc1csc(C(C)Nc2ccnc(NN)n2)n1
InChIInChI=1S/C10H14N6S/c1-6-5-17-9(13-6)7(2)14-8-3-4-12-10(15-8)16-11/h3-5,7H,11H2,1-2H3,(H2,12,14,15,16)
InChIKeyORHIFXOWPXPOMV-UHFFFAOYSA-N
MW250.33 g/mol
LogP1.70
Rot. Bonds4

About 2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine

2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine (PubChem CID 80917622) has the molecular formula C10H14N6S and a molecular weight of 250.33 g/mol. Its IUPAC name is 2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
PubChem CID80917622
Molecular FormulaC10H14N6S
Molecular Weight250.33 g/mol
Exact Mass250.10
IUPAC Name2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
SMILESCc1csc(C(C)Nc2ccnc(NN)n2)n1
InChIInChI=1S/C10H14N6S/c1-6-5-17-9(13-6)7(2)14-8-3-4-12-10(15-8)16-11/h3-5,7H,11H2,1-2H3,(H2,12,14,15,16)
InChIKeyORHIFXOWPXPOMV-UHFFFAOYSA-N
XLogP1.70
TPSA88.75 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 51.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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 2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine?
The IUPAC name of 2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine (CID 80917622) is 2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine.
What is the SMILES notation for 2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine?
The canonical SMILES for 2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine is Cc1csc(C(C)Nc2ccnc(NN)n2)n1.
What is the InChIKey of 2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine?
The InChIKey is ORHIFXOWPXPOMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6S/c1-6-5-17-9(13-6)7(2)14-8-3-4-12-10(15-8)16-11/h3-5,7H,11H2,1-2H3,(H2,12,14,15,16).
What are the key properties of 2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine?
2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine has a molecular weight of 250.33 g/mol, XLogP of 1.70, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine is sourced from PubChem (CID 80917622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).