[2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine

C14H18N4O — CID 105203747

IUPAC[2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine
SMILESCOc1ccc(C)cc1CC(NN)c1ncccn1
InChIInChI=1S/C14H18N4O/c1-10-4-5-13(19-2)11(8-10)9-12(18-15)14-16-6-3-7-17-14/h3-8,12,18H,9,15H2,1-2H3
InChIKeyPUDVDBJLSYBHPE-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.54
Rot. Bonds5

About [2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine

[2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine (PubChem CID 105203747) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is [2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine
PubChem CID105203747
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name[2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine
SMILESCOc1ccc(C)cc1CC(NN)c1ncccn1
InChIInChI=1S/C14H18N4O/c1-10-4-5-13(19-2)11(8-10)9-12(18-15)14-16-6-3-7-17-14/h3-8,12,18H,9,15H2,1-2H3
InChIKeyPUDVDBJLSYBHPE-UHFFFAOYSA-N
XLogP1.54
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.54
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

[2-(5-bromo-2-methoxyphenyl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
CID 105261563
[1-(2-chlorophenyl)-2-(2-methoxy-5-methylphenyl)ethyl]hydrazine
CID 105211135
[1-(2-iodophenyl)-2-(2-methoxy-5-methylphenyl)ethyl]hydrazine
CID 105291970
[2-(2-methoxy-5-methylphenyl)-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105228781
[(2-methoxy-5-methylphenyl)-pyrimidin-2-ylmethyl]hydrazine
CID 105203659
2-(5-chloro-2-methoxyphenyl)-N-methyl-1-pyrimidin-2-ylethanamine
CID 62600240
4-fluoro-2-[1-hydrazinyl-2-(2-methoxy-5-methylphenyl)ethyl]aniline
CID 105263260
[1-(2-methoxy-5-methylphenyl)-3,3-dimethylbutan-2-yl]hydrazine
CID 105203112
[1,1-dimethoxy-3-(2-methoxy-5-methylphenyl)propan-2-yl]hydrazine
CID 105246103
2-(2-methoxy-5-methylphenyl)-N-methyl-1-pyrazin-2-ylethanamine
CID 62160695
1-(2-methoxy-5-methylphenyl)-N-methyl-3-pyridin-2-ylpropan-2-amine
CID 62160862
N-ethyl-2-(2-methoxy-5-methylphenyl)-1-pyridin-4-ylethanamine
CID 62161192

Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine?
The IUPAC name of [2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine (CID 105203747) is [2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine.
What is the SMILES notation for [2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine?
The canonical SMILES for [2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine is COc1ccc(C)cc1CC(NN)c1ncccn1.
What is the InChIKey of [2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine?
The InChIKey is PUDVDBJLSYBHPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-10-4-5-13(19-2)11(8-10)9-12(18-15)14-16-6-3-7-17-14/h3-8,12,18H,9,15H2,1-2H3.
What are the key properties of [2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine?
[2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine has a molecular weight of 258.32 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxy-5-methylphenyl)-1-pyrimidin-2-ylethyl]hydrazine is sourced from PubChem (CID 105203747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).