[6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine

C13H15ClN4O — CID 80922291

IUPAC[6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine
SMILESCCc1c(NN)ncnc1OCc1ccc(Cl)cc1
InChIInChI=1S/C13H15ClN4O/c1-2-11-12(18-15)16-8-17-13(11)19-7-9-3-5-10(14)6-4-9/h3-6,8H,2,7,15H2,1H3,(H,16,17,18)
InChIKeyTZLSPQINJUDEDV-UHFFFAOYSA-N
MW278.74 g/mol
LogP2.56
Rot. Bonds5

About [6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine

[6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine (PubChem CID 80922291) has the molecular formula C13H15ClN4O and a molecular weight of 278.74 g/mol. Its IUPAC name is [6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine
PubChem CID80922291
Molecular FormulaC13H15ClN4O
Molecular Weight278.74 g/mol
Exact Mass278.09
IUPAC Name[6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine
SMILESCCc1c(NN)ncnc1OCc1ccc(Cl)cc1
InChIInChI=1S/C13H15ClN4O/c1-2-11-12(18-15)16-8-17-13(11)19-7-9-3-5-10(14)6-4-9/h3-6,8H,2,7,15H2,1H3,(H,16,17,18)
InChIKeyTZLSPQINJUDEDV-UHFFFAOYSA-N
XLogP2.56
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 52.56
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-[(4-chlorophenyl)methoxy]-5-propylpyrimidin-4-yl]hydrazine
CID 80922462
[5-ethyl-6-[(4-methoxyphenyl)methoxy]pyrimidin-4-yl]hydrazine
CID 80913387
6-[(4-bromophenyl)methoxy]-5-ethyl-N-methylpyrimidin-4-amine
CID 82825139
5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine
CID 80867429
6-[(3-chlorophenyl)methoxy]-5-ethyl-N-methylpyrimidin-4-amine
CID 80876248
(5-ethyl-6-heptoxypyrimidin-4-yl)hydrazine
CID 80910142
[6-[(5-chloro-3-pyridinyl)oxy]-5-ethylpyrimidin-4-yl]hydrazine
CID 80921561
4-chloro-5-ethyl-6-phenylmethoxypyrimidine
CID 55230236
4-chloro-6-[(4-chlorophenyl)methoxy]-5-methylpyrimidine
CID 65126013
[5-ethyl-6-(3-methylbutan-2-yloxy)pyrimidin-4-yl]hydrazine
CID 80922712
[5-ethyl-6-(4,4,4-trifluorobutoxy)pyrimidin-4-yl]hydrazine
CID 82795276
[6-[(4-chlorophenyl)methylsulfanyl]-5-propylpyrimidin-4-yl]hydrazine
CID 114793144

Frequently Asked Questions

What is the IUPAC name of [6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine (CID 80922291) is [6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine is CCc1c(NN)ncnc1OCc1ccc(Cl)cc1.
What is the InChIKey of [6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine?
The InChIKey is TZLSPQINJUDEDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN4O/c1-2-11-12(18-15)16-8-17-13(11)19-7-9-3-5-10(14)6-4-9/h3-6,8H,2,7,15H2,1H3,(H,16,17,18).
What are the key properties of [6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine?
[6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine has a molecular weight of 278.74 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(4-chlorophenyl)methoxy]-5-ethylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80922291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).