(6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine

C11H18N4S — CID 80929974

IUPAC(6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
SMILESCc1nc(NN)c(C)c(SC2CCCC2)n1
InChIInChI=1S/C11H18N4S/c1-7-10(15-12)13-8(2)14-11(7)16-9-5-3-4-6-9/h9H,3-6,12H2,1-2H3,(H,13,14,15)
InChIKeyABOKWLTYWMCCTB-UHFFFAOYSA-N
MW238.36 g/mol
LogP2.41
Rot. Bonds3

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

(6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine (PubChem CID 80929974) has the molecular formula C11H18N4S and a molecular weight of 238.36 g/mol. Its IUPAC name is (6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
PubChem CID80929974
Molecular FormulaC11H18N4S
Molecular Weight238.36 g/mol
Exact Mass238.13
IUPAC Name(6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
SMILESCc1nc(NN)c(C)c(SC2CCCC2)n1
InChIInChI=1S/C11H18N4S/c1-7-10(15-12)13-8(2)14-11(7)16-9-5-3-4-6-9/h9H,3-6,12H2,1-2H3,(H,13,14,15)
InChIKeyABOKWLTYWMCCTB-UHFFFAOYSA-N
XLogP2.41
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 52.41
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-(cyclopentylmethylsulfanyl)-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 80930091
6-cyclopentylsulfanyl-2,5-dimethyl-N-propylpyrimidin-4-amine
CID 80889840
(6-cyclohexylsulfanyl-5-methyl-2-propylpyrimidin-4-yl)hydrazine
CID 81001237
N-cyclopentyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 80932373
(6-tert-butylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
CID 80924800
(6-ethylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
CID 80925717
[5-methyl-6-(oxan-4-ylsulfanyl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 81001666
[6-(cyclohexylmethoxy)-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 80924193
N-(3-cyclopentylpropyl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 114137258
(6-butan-2-ylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine
CID 80925464
(3,5-dichloro-6-cyclopentylsulfanyl-2-pyridinyl)hydrazine
CID 102763301
[5-methyl-6-(oxetan-3-ylsulfanyl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80995930

Frequently Asked Questions

What is the IUPAC name of (6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
The IUPAC name of (6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine (CID 80929974) is (6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine is Cc1nc(NN)c(C)c(SC2CCCC2)n1.
What is the InChIKey of (6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
The InChIKey is ABOKWLTYWMCCTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4S/c1-7-10(15-12)13-8(2)14-11(7)16-9-5-3-4-6-9/h9H,3-6,12H2,1-2H3,(H,13,14,15).
What are the key properties of (6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine?
(6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine has a molecular weight of 238.36 g/mol, XLogP of 2.41, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-cyclopentylsulfanyl-2,5-dimethylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 80929974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).