[2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine

C14H25N5 — CID 80964981

IUPAC[2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine
SMILESCCC1CCCN1c1cc(NN)nc(C(C)(C)C)n1
InChIInChI=1S/C14H25N5/c1-5-10-7-6-8-19(10)12-9-11(18-15)16-13(17-12)14(2,3)4/h9-10H,5-8,15H2,1-4H3,(H,16,17,18)
InChIKeyRYWJRKXDBKTIRH-UHFFFAOYSA-N
MW263.39 g/mol
LogP2.44
Rot. Bonds3

About [2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine

[2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine (PubChem CID 80964981) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is [2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine
PubChem CID80964981
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name[2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine
SMILESCCC1CCCN1c1cc(NN)nc(C(C)(C)C)n1
InChIInChI=1S/C14H25N5/c1-5-10-7-6-8-19(10)12-9-11(18-15)16-13(17-12)14(2,3)4/h9-10H,5-8,15H2,1-4H3,(H,16,17,18)
InChIKeyRYWJRKXDBKTIRH-UHFFFAOYSA-N
XLogP2.44
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 52.44
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

3-[1-(2-tert-butyl-6-hydrazinylpyrimidin-4-yl)pyrrolidin-2-yl]propan-1-ol
CID 80964573
6-(2-ethylpyrrolidin-1-yl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106770980
1-[1-[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 106775658
[6-(2-ethylpyrrolidin-1-yl)pyrazin-2-yl]hydrazine
CID 80898993
[2-tert-butyl-6-(2,4-dimethylpiperidin-1-yl)pyrimidin-4-yl]hydrazine
CID 80964463
[2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)-5-methylpyrimidin-4-yl]hydrazine
CID 80994714
2-cyclopropyl-6-(2-ethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine
CID 80967096
[2-tert-butyl-6-(2-methyl-1,4-oxazepan-4-yl)pyrimidin-4-yl]hydrazine
CID 80965044
2-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine
CID 80933803
[2-cyclopropyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine
CID 83056734
4-hydrazinyl-6-(2-propylpiperidin-1-yl)pyrimidin-2-amine
CID 83057547
N-ethyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80798245

Frequently Asked Questions

What is the IUPAC name of [2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine (CID 80964981) is [2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine is CCC1CCCN1c1cc(NN)nc(C(C)(C)C)n1.
What is the InChIKey of [2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine?
The InChIKey is RYWJRKXDBKTIRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-5-10-7-6-8-19(10)12-9-11(18-15)16-13(17-12)14(2,3)4/h9-10H,5-8,15H2,1-4H3,(H,16,17,18).
What are the key properties of [2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine?
[2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine has a molecular weight of 263.39 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80964981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).