[2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine

C15H25N5 — CID 80968250

IUPAC[2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine
SMILESCC1(C)CCCN(c2cc(NN)nc(C3CC3)n2)CC1
InChIInChI=1S/C15H25N5/c1-15(2)6-3-8-20(9-7-15)13-10-12(19-16)17-14(18-13)11-4-5-11/h10-11H,3-9,16H2,1-2H3,(H,17,18,19)
InChIKeyHGUMBDOXIXEPBY-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.66
Rot. Bonds3

About [2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine

[2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine (PubChem CID 80968250) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is [2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine
PubChem CID80968250
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name[2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine
SMILESCC1(C)CCCN(c2cc(NN)nc(C3CC3)n2)CC1
InChIInChI=1S/C15H25N5/c1-15(2)6-3-8-20(9-7-15)13-10-12(19-16)17-14(18-13)11-4-5-11/h10-11H,3-9,16H2,1-2H3,(H,17,18,19)
InChIKeyHGUMBDOXIXEPBY-UHFFFAOYSA-N
XLogP2.66
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.66
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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Frequently Asked Questions

What is the IUPAC name of [2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine (CID 80968250) is [2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine is CC1(C)CCCN(c2cc(NN)nc(C3CC3)n2)CC1.
What is the InChIKey of [2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine?
The InChIKey is HGUMBDOXIXEPBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-15(2)6-3-8-20(9-7-15)13-10-12(19-16)17-14(18-13)11-4-5-11/h10-11H,3-9,16H2,1-2H3,(H,17,18,19).
What are the key properties of [2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine?
[2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine has a molecular weight of 275.40 g/mol, XLogP of 2.66, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclopropyl-6-(4,4-dimethylazepan-1-yl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80968250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).