[6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine

C14H25N5 — CID 80947173

IUPAC[6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine
SMILESCCCc1nc(NN)cc(N2CCCCCC2C)n1
InChIInChI=1S/C14H25N5/c1-3-7-12-16-13(18-15)10-14(17-12)19-9-6-4-5-8-11(19)2/h10-11H,3-9,15H2,1-2H3,(H,16,17,18)
InChIKeyOHYCCHVHOIAHDT-UHFFFAOYSA-N
MW263.39 g/mol
LogP2.48
Rot. Bonds4

About [6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine

[6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine (PubChem CID 80947173) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is [6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine
PubChem CID80947173
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name[6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine
SMILESCCCc1nc(NN)cc(N2CCCCCC2C)n1
InChIInChI=1S/C14H25N5/c1-3-7-12-16-13(18-15)10-14(17-12)19-9-6-4-5-8-11(19)2/h10-11H,3-9,15H2,1-2H3,(H,16,17,18)
InChIKeyOHYCCHVHOIAHDT-UHFFFAOYSA-N
XLogP2.48
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 52.48
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 [6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine (CID 80947173) is [6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine is CCCc1nc(NN)cc(N2CCCCCC2C)n1.
What is the InChIKey of [6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine?
The InChIKey is OHYCCHVHOIAHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-3-7-12-16-13(18-15)10-14(17-12)19-9-6-4-5-8-11(19)2/h10-11H,3-9,15H2,1-2H3,(H,16,17,18).
What are the key properties of [6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine?
[6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine has a molecular weight of 263.39 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80947173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).