N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine

C12H23N5O — CID 80940196

IUPACN,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine
SMILESCCc1nc(NN)cc(OCCN(CC)CC)n1
InChIInChI=1S/C12H23N5O/c1-4-10-14-11(16-13)9-12(15-10)18-8-7-17(5-2)6-3/h9H,4-8,13H2,1-3H3,(H,14,15,16)
InChIKeyNXJQOXVUMQUXIO-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.05
Rot. Bonds8

About N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine

N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine (PubChem CID 80940196) has the molecular formula C12H23N5O and a molecular weight of 253.35 g/mol. Its IUPAC name is N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine.

Molecular Properties

Compound NameN,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine
PubChem CID80940196
Molecular FormulaC12H23N5O
Molecular Weight253.35 g/mol
Exact Mass253.19
IUPAC NameN,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine
SMILESCCc1nc(NN)cc(OCCN(CC)CC)n1
InChIInChI=1S/C12H23N5O/c1-4-10-14-11(16-13)9-12(15-10)18-8-7-17(5-2)6-3/h9H,4-8,13H2,1-3H3,(H,14,15,16)
InChIKeyNXJQOXVUMQUXIO-UHFFFAOYSA-N
XLogP1.05
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.05
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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Related Compounds

6-[2-(diethylamino)ethoxy]-2-ethyl-N-propylpyrimidin-4-amine
CID 80942263
2-(6-hydrazinyl-2-propylpyrimidin-4-yl)oxy-N,N-dimethylethanamine
CID 80947210
[2-ethyl-6-(2-phenoxyethoxy)pyrimidin-4-yl]hydrazine
CID 80939342
6-[2-(diethylamino)ethoxy]-4-N-methylpyrimidine-2,4-diamine
CID 80871216
(6-ethoxy-2-propylpyrimidin-4-yl)hydrazine
CID 80947198
[6-(3-methylbutoxy)-2-propylpyrimidin-4-yl]hydrazine
CID 80947494
6-[2-(diethylamino)ethoxy]-N-ethyl-2-methylpyrimidin-4-amine
CID 80871813
N,N-diethyl-2-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyethanamine
CID 81001085
6-[3-(dimethylamino)propoxy]-N,2-diethylpyrimidin-4-amine
CID 80941359
[6-(2-cyclopropylethoxy)-2-propylpyrimidin-4-yl]hydrazine
CID 106207866
(2-ethyl-6-phenoxypyrimidin-4-yl)hydrazine
CID 80939130
2-tert-butyl-6-[2-(diethylamino)ethoxy]-N-methylpyrimidin-4-amine
CID 80963364

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine?
The IUPAC name of N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine (CID 80940196) is N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine.
What is the SMILES notation for N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine?
The canonical SMILES for N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine is CCc1nc(NN)cc(OCCN(CC)CC)n1.
What is the InChIKey of N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine?
The InChIKey is NXJQOXVUMQUXIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5O/c1-4-10-14-11(16-13)9-12(15-10)18-8-7-17(5-2)6-3/h9H,4-8,13H2,1-3H3,(H,14,15,16).
What are the key properties of N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine?
N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine has a molecular weight of 253.35 g/mol, XLogP of 1.05, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(2-ethyl-6-hydrazinylpyrimidin-4-yl)oxyethanamine is sourced from PubChem (CID 80940196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).