(2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine

C11H14N6S — CID 80947503

IUPAC(2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine
SMILESCCCc1nc(NN)cc(Sc2ncccn2)n1
InChIInChI=1S/C11H14N6S/c1-2-4-8-15-9(17-12)7-10(16-8)18-11-13-5-3-6-14-11/h3,5-7H,2,4,12H2,1H3,(H,15,16,17)
InChIKeyUTHHHOFUBGCEID-UHFFFAOYSA-N
MW262.34 g/mol
LogP1.66
Rot. Bonds5

About (2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine

(2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine (PubChem CID 80947503) has the molecular formula C11H14N6S and a molecular weight of 262.34 g/mol. Its IUPAC name is (2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine
PubChem CID80947503
Molecular FormulaC11H14N6S
Molecular Weight262.34 g/mol
Exact Mass262.10
IUPAC Name(2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine
SMILESCCCc1nc(NN)cc(Sc2ncccn2)n1
InChIInChI=1S/C11H14N6S/c1-2-4-8-15-9(17-12)7-10(16-8)18-11-13-5-3-6-14-11/h3,5-7H,2,4,12H2,1H3,(H,15,16,17)
InChIKeyUTHHHOFUBGCEID-UHFFFAOYSA-N
XLogP1.66
TPSA89.61 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.34
LogP ≤ 51.66
H-Bond Donors ≤ 52
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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Related Compounds

[6-(3-bromophenyl)sulfanyl-2-propylpyrimidin-4-yl]hydrazine
CID 80947692
6-hydrazinyl-2-propylpyrimidin-4-amine
CID 80947336
[6-(2-methylpropylsulfanyl)-2-propylpyrimidin-4-yl]hydrazine
CID 80947009
2-[6-(ethylamino)-2-propylpyrimidin-4-yl]sulfanylpyrimidine-4,6-diamine
CID 80943080
(6-ethoxy-2-propylpyrimidin-4-yl)hydrazine
CID 80947198
[6-(2-nitrophenyl)sulfanyl-2-propylpyrimidin-4-yl]hydrazine
CID 80943848
(2-cyclopropyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine
CID 80979379
6-[(3-chloro-2-pyridinyl)sulfanyl]-N-methyl-2-propylpyrimidin-4-amine
CID 80946945
[2-(methoxymethyl)-6-(4-methylpyrimidin-2-yl)sulfanylpyrimidin-4-yl]hydrazine
CID 113402011
6-hydrazinyl-2-propyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 80946582
[2-ethyl-6-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyrimidin-4-yl]hydrazine
CID 80938720
N-ethyl-6-hydrazinyl-2-propyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 80943671

Frequently Asked Questions

What is the IUPAC name of (2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine?
The IUPAC name of (2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine (CID 80947503) is (2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine is CCCc1nc(NN)cc(Sc2ncccn2)n1.
What is the InChIKey of (2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine?
The InChIKey is UTHHHOFUBGCEID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6S/c1-2-4-8-15-9(17-12)7-10(16-8)18-11-13-5-3-6-14-11/h3,5-7H,2,4,12H2,1H3,(H,15,16,17).
What are the key properties of (2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine?
(2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine has a molecular weight of 262.34 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propyl-6-pyrimidin-2-ylsulfanylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 80947503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).