[6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine

C15H25N5 — CID 80968593

IUPAC[6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCC(C)c1nc(NN)cc(N2CCCC3CCCC32)n1
InChIInChI=1S/C15H25N5/c1-10(2)15-17-13(19-16)9-14(18-15)20-8-4-6-11-5-3-7-12(11)20/h9-12H,3-8,16H2,1-2H3,(H,17,18,19)
InChIKeyGIPIIBRFMREECA-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.65
Rot. Bonds3

About [6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine

[6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 80968593) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is [6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID80968593
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name[6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCC(C)c1nc(NN)cc(N2CCCC3CCCC32)n1
InChIInChI=1S/C15H25N5/c1-10(2)15-17-13(19-16)9-14(18-15)20-8-4-6-11-5-3-7-12(11)20/h9-12H,3-8,16H2,1-2H3,(H,17,18,19)
InChIKeyGIPIIBRFMREECA-UHFFFAOYSA-N
XLogP2.65
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 ≤ 52.65
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-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-methylsulfanylpyrimidin-4-yl]hydrazine
CID 80930524
1-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)piperidine-2-carboxamide
CID 80964808
[1-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methanol
CID 80964876
[6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)pyrazin-2-yl]hydrazine
CID 80931290
[6-(3,5-dimethylpiperidin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80969211
6-(2-cyclopentylpyrrolidin-1-yl)-4-N-methylpyrimidine-2,4-diamine
CID 80819254
N-cyclopropyl-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968411
[2-cyclopropyl-6-(2-propan-2-ylpyrrolidin-1-yl)pyrimidin-4-yl]hydrazine
CID 80969506
N-ethyl-2-propan-2-yl-6-(2-propan-2-ylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80959790
[6-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80969411
6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine
CID 83027793
N-cyclooctyl-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968823

Frequently Asked Questions

What is the IUPAC name of [6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine (CID 80968593) is [6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine is CC(C)c1nc(NN)cc(N2CCCC3CCCC32)n1.
What is the InChIKey of [6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is GIPIIBRFMREECA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-10(2)15-17-13(19-16)9-14(18-15)20-8-4-6-11-5-3-7-12(11)20/h9-12H,3-8,16H2,1-2H3,(H,17,18,19).
What are the key properties of [6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
[6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 275.40 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80968593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).