(2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine

C13H24N4O — CID 81000285

IUPAC(2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine
SMILESCCCCCCOc1nc(CC)nc(NN)c1C
InChIInChI=1S/C13H24N4O/c1-4-6-7-8-9-18-13-10(3)12(17-14)15-11(5-2)16-13/h4-9,14H2,1-3H3,(H,15,16,17)
InChIKeyDYHVRDHCCHMWSY-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.59
Rot. Bonds8

About (2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine

(2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine (PubChem CID 81000285) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is (2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine
PubChem CID81000285
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name(2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine
SMILESCCCCCCOc1nc(CC)nc(NN)c1C
InChIInChI=1S/C13H24N4O/c1-4-6-7-8-9-18-13-10(3)12(17-14)15-11(5-2)16-13/h4-9,14H2,1-3H3,(H,15,16,17)
InChIKeyDYHVRDHCCHMWSY-UHFFFAOYSA-N
XLogP2.59
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.59
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'}

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Related Compounds

[2-ethyl-6-[3-(2-methoxyethoxy)propoxy]-5-methylpyrimidin-4-yl]hydrazine
CID 103408611
2-ethyl-6-hexoxy-5-methylpyrimidin-4-amine
CID 80989158
N,N-diethyl-2-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyethanamine
CID 81001085
4-chloro-2-ethyl-6-hexoxy-5-methylpyrimidine
CID 80973551
N,2-diethyl-5-methyl-6-propoxypyrimidin-4-amine
CID 80989328
[6-[2-(3-methoxypropoxy)ethoxy]-5-methyl-2-propylpyrimidin-4-yl]hydrazine
CID 103176603
2-ethyl-5-methyl-6-propoxy-N-propylpyrimidin-4-amine
CID 80989654
[2-ethyl-5-methyl-6-(2,2,3,3-tetrafluoropropoxy)pyrimidin-4-yl]hydrazine
CID 81000943
(5-ethyl-6-heptoxypyrimidin-4-yl)hydrazine
CID 80910142
[2-ethyl-5-methyl-6-(2-methylphenoxy)pyrimidin-4-yl]hydrazine
CID 81000967
[2-ethyl-5-methyl-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]pyrimidin-4-yl]hydrazine
CID 106598871
2-ethyl-6-(2-methoxyethoxy)-N,5-dimethylpyrimidin-4-amine
CID 80988826

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine?
The IUPAC name of (2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine (CID 81000285) is (2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine is CCCCCCOc1nc(CC)nc(NN)c1C.
What is the InChIKey of (2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine?
The InChIKey is DYHVRDHCCHMWSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-4-6-7-8-9-18-13-10(3)12(17-14)15-11(5-2)16-13/h4-9,14H2,1-3H3,(H,15,16,17).
What are the key properties of (2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine?
(2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine has a molecular weight of 252.36 g/mol, XLogP of 2.59, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-6-hexoxy-5-methylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 81000285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).