(5-bromo-4-pentoxypyrimidin-2-yl)hydrazine

C9H15BrN4O — CID 80911741

IUPAC(5-bromo-4-pentoxypyrimidin-2-yl)hydrazine
SMILESCCCCCOc1nc(NN)ncc1Br
InChIInChI=1S/C9H15BrN4O/c1-2-3-4-5-15-8-7(10)6-12-9(13-8)14-11/h6H,2-5,11H2,1H3,(H,12,13,14)
InChIKeyAMRDWENRNMWLDC-UHFFFAOYSA-N
MW275.15 g/mol
LogP2.09
Rot. Bonds6

About (5-bromo-4-pentoxypyrimidin-2-yl)hydrazine

(5-bromo-4-pentoxypyrimidin-2-yl)hydrazine (PubChem CID 80911741) has the molecular formula C9H15BrN4O and a molecular weight of 275.15 g/mol. Its IUPAC name is (5-bromo-4-pentoxypyrimidin-2-yl)hydrazine.

Molecular Properties

Compound Name(5-bromo-4-pentoxypyrimidin-2-yl)hydrazine
PubChem CID80911741
Molecular FormulaC9H15BrN4O
Molecular Weight275.15 g/mol
Exact Mass274.04
IUPAC Name(5-bromo-4-pentoxypyrimidin-2-yl)hydrazine
SMILESCCCCCOc1nc(NN)ncc1Br
InChIInChI=1S/C9H15BrN4O/c1-2-3-4-5-15-8-7(10)6-12-9(13-8)14-11/h6H,2-5,11H2,1H3,(H,12,13,14)
InChIKeyAMRDWENRNMWLDC-UHFFFAOYSA-N
XLogP2.09
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.15
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (5-bromo-4-pentoxypyrimidin-2-yl)hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[5-bromo-4-(4,4,4-trifluorobutoxy)pyrimidin-2-yl]hydrazine
CID 82793945
[5-bromo-4-[2-(3-methoxypropoxy)ethoxy]pyrimidin-2-yl]hydrazine
CID 103176581
[5-bromo-4-(2-phenoxyethoxy)pyrimidin-2-yl]hydrazine
CID 80908991
[5-bromo-4-(4-propoxyphenoxy)pyrimidin-2-yl]hydrazine
CID 80916147
5-bromo-4-(2-butoxyethoxy)-N-ethylpyrimidin-2-amine
CID 80861009
(5-fluoro-4-propoxypyrimidin-2-yl)hydrazine
CID 80911557
5-bromo-4-propoxy-N-propylpyrimidin-2-amine
CID 80865318
3-[5-bromo-2-(propylamino)pyrimidin-4-yl]oxypropan-1-ol
CID 80865636
3-[5-bromo-2-(ethylamino)pyrimidin-4-yl]oxypropan-1-ol
CID 80866531
5-bromo-2-hydrazinyl-N-octan-4-ylpyrimidin-4-amine
CID 106026014
[5-methyl-4-(2-propoxyethoxy)pyrimidin-2-yl]hydrazine
CID 80925219
5-bromo-4-(2-methoxyethoxy)-N-propylpyrimidin-2-amine
CID 80858542

Frequently Asked Questions

What is the IUPAC name of (5-bromo-4-pentoxypyrimidin-2-yl)hydrazine?
The IUPAC name of (5-bromo-4-pentoxypyrimidin-2-yl)hydrazine (CID 80911741) is (5-bromo-4-pentoxypyrimidin-2-yl)hydrazine.
What is the SMILES notation for (5-bromo-4-pentoxypyrimidin-2-yl)hydrazine?
The canonical SMILES for (5-bromo-4-pentoxypyrimidin-2-yl)hydrazine is CCCCCOc1nc(NN)ncc1Br.
What is the InChIKey of (5-bromo-4-pentoxypyrimidin-2-yl)hydrazine?
The InChIKey is AMRDWENRNMWLDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15BrN4O/c1-2-3-4-5-15-8-7(10)6-12-9(13-8)14-11/h6H,2-5,11H2,1H3,(H,12,13,14).
What are the key properties of (5-bromo-4-pentoxypyrimidin-2-yl)hydrazine?
(5-bromo-4-pentoxypyrimidin-2-yl)hydrazine has a molecular weight of 275.15 g/mol, XLogP of 2.09, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-4-pentoxypyrimidin-2-yl)hydrazine is sourced from PubChem (CID 80911741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).