[6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine

C14H20N6 — CID 113390594

IUPAC[6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine
SMILESCCn1cncc1-c1nc(NN)cc(C2CCCC2)n1
InChIInChI=1S/C14H20N6/c1-2-20-9-16-8-12(20)14-17-11(7-13(18-14)19-15)10-5-3-4-6-10/h7-10H,2-6,15H2,1H3,(H,17,18,19)
InChIKeyINZVRJHPPMHJSI-UHFFFAOYSA-N
MW272.36 g/mol
LogP2.30
Rot. Bonds4

About [6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine

[6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine (PubChem CID 113390594) has the molecular formula C14H20N6 and a molecular weight of 272.36 g/mol. Its IUPAC name is [6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine
PubChem CID113390594
Molecular FormulaC14H20N6
Molecular Weight272.36 g/mol
Exact Mass272.17
IUPAC Name[6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine
SMILESCCn1cncc1-c1nc(NN)cc(C2CCCC2)n1
InChIInChI=1S/C14H20N6/c1-2-20-9-16-8-12(20)14-17-11(7-13(18-14)19-15)10-5-3-4-6-10/h7-10H,2-6,15H2,1H3,(H,17,18,19)
InChIKeyINZVRJHPPMHJSI-UHFFFAOYSA-N
XLogP2.30
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.36
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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 [6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine (CID 113390594) is [6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine is CCn1cncc1-c1nc(NN)cc(C2CCCC2)n1.
What is the InChIKey of [6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine?
The InChIKey is INZVRJHPPMHJSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6/c1-2-20-9-16-8-12(20)14-17-11(7-13(18-14)19-15)10-5-3-4-6-10/h7-10H,2-6,15H2,1H3,(H,17,18,19).
What are the key properties of [6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine?
[6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine has a molecular weight of 272.36 g/mol, XLogP of 2.30, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-cyclopentyl-2-(3-ethylimidazol-4-yl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 113390594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).