(6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine

C10H18N4S — CID 80924800

IUPAC(6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
SMILESCc1nc(NN)c(C)c(SC(C)(C)C)n1
InChIInChI=1S/C10H18N4S/c1-6-8(14-11)12-7(2)13-9(6)15-10(3,4)5/h11H2,1-5H3,(H,12,13,14)
InChIKeyRJHCRQZJKMNCRB-UHFFFAOYSA-N
MW226.35 g/mol
LogP2.27
Rot. Bonds2

About (6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine

(6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine (PubChem CID 80924800) has the molecular formula C10H18N4S and a molecular weight of 226.35 g/mol. Its IUPAC name is (6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
PubChem CID80924800
Molecular FormulaC10H18N4S
Molecular Weight226.35 g/mol
Exact Mass226.13
IUPAC Name(6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
SMILESCc1nc(NN)c(C)c(SC(C)(C)C)n1
InChIInChI=1S/C10H18N4S/c1-6-8(14-11)12-7(2)13-9(6)15-10(3,4)5/h11H2,1-5H3,(H,12,13,14)
InChIKeyRJHCRQZJKMNCRB-UHFFFAOYSA-N
XLogP2.27
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 52.27
H-Bond Donors ≤ 52
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

(6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
CID 80925717
(6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
CID 80929974
[6-(cyclopentylmethylsulfanyl)-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 80930091
(6-butan-2-ylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
CID 80925464
[6-(3,4-difluorophenyl)sulfanyl-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 80925558
2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]ethanol
CID 80932442
(6-methoxy-2,5-dimethylpyrimidin-4-yl)hydrazine
CID 55280081
2-(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)sulfanyl-1H-pyrimidin-6-one
CID 80925999
6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine
CID 106294474
6-hydrazinyl-2,5-dimethyl-N-(4,4,4-trifluorobutyl)pyrimidin-4-amine
CID 115523268
N'-(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)-N,N,2,2-tetramethylpropane-1,3-diamine
CID 80932586
2-ethyl-2-[[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]methyl]butan-1-ol
CID 114164988

Frequently Asked Questions

What is the IUPAC name of (6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
The IUPAC name of (6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine (CID 80924800) is (6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine is Cc1nc(NN)c(C)c(SC(C)(C)C)n1.
What is the InChIKey of (6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
The InChIKey is RJHCRQZJKMNCRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S/c1-6-8(14-11)12-7(2)13-9(6)15-10(3,4)5/h11H2,1-5H3,(H,12,13,14).
What are the key properties of (6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
(6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine has a molecular weight of 226.35 g/mol, XLogP of 2.27, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 80924800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).