(6-phenoxy-2-propylpyrimidin-4-yl)hydrazine

C13H16N4O — CID 80946591

IUPAC(6-phenoxy-2-propylpyrimidin-4-yl)hydrazine
SMILESCCCc1nc(NN)cc(Oc2ccccc2)n1
InChIInChI=1S/C13H16N4O/c1-2-6-11-15-12(17-14)9-13(16-11)18-10-7-4-3-5-8-10/h3-5,7-9H,2,6,14H2,1H3,(H,15,16,17)
InChIKeyUXVMSKXDEDWKHQ-UHFFFAOYSA-N
MW244.30 g/mol
LogP2.51
Rot. Bonds5

About (6-phenoxy-2-propylpyrimidin-4-yl)hydrazine

(6-phenoxy-2-propylpyrimidin-4-yl)hydrazine (PubChem CID 80946591) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is (6-phenoxy-2-propylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-phenoxy-2-propylpyrimidin-4-yl)hydrazine
PubChem CID80946591
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name(6-phenoxy-2-propylpyrimidin-4-yl)hydrazine
SMILESCCCc1nc(NN)cc(Oc2ccccc2)n1
InChIInChI=1S/C13H16N4O/c1-2-6-11-15-12(17-14)9-13(16-11)18-10-7-4-3-5-8-10/h3-5,7-9H,2,6,14H2,1H3,(H,15,16,17)
InChIKeyUXVMSKXDEDWKHQ-UHFFFAOYSA-N
XLogP2.51
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 52.51
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-ethyl-6-phenoxypyrimidin-4-yl)hydrazine
CID 80939130
[6-(3-methylphenoxy)-2-propylpyrimidin-4-yl]hydrazine
CID 80947768
[6-(4-bromophenoxy)-2-propylpyrimidin-4-yl]hydrazine
CID 80947208
6-phenoxy-N,2-dipropylpyrimidin-4-amine
CID 80949625
[6-(3,5-difluorophenoxy)-2-propylpyrimidin-4-yl]hydrazine
CID 80947113
(6-ethoxy-2-propylpyrimidin-4-yl)hydrazine
CID 80947198
[6-(2-fluoro-3-methylphenoxy)-2-propylpyrimidin-4-yl]hydrazine
CID 107662936
[2-ethyl-6-(3-methoxyphenoxy)pyrimidin-4-yl]hydrazine
CID 80940048
[6-(3-bromophenoxy)-2-ethylpyrimidin-4-yl]hydrazine
CID 80939353
[2-ethyl-6-(2-phenoxyethoxy)pyrimidin-4-yl]hydrazine
CID 80939342
6-(4-chlorophenoxy)-N-ethyl-2-propylpyrimidin-4-amine
CID 80949548
6-(3-ethylphenoxy)-N-methyl-2-propylpyrimidin-4-amine
CID 80950205

Frequently Asked Questions

What is the IUPAC name of (6-phenoxy-2-propylpyrimidin-4-yl)hydrazine?
The IUPAC name of (6-phenoxy-2-propylpyrimidin-4-yl)hydrazine (CID 80946591) is (6-phenoxy-2-propylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (6-phenoxy-2-propylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (6-phenoxy-2-propylpyrimidin-4-yl)hydrazine is CCCc1nc(NN)cc(Oc2ccccc2)n1.
What is the InChIKey of (6-phenoxy-2-propylpyrimidin-4-yl)hydrazine?
The InChIKey is UXVMSKXDEDWKHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-2-6-11-15-12(17-14)9-13(16-11)18-10-7-4-3-5-8-10/h3-5,7-9H,2,6,14H2,1H3,(H,15,16,17).
What are the key properties of (6-phenoxy-2-propylpyrimidin-4-yl)hydrazine?
(6-phenoxy-2-propylpyrimidin-4-yl)hydrazine has a molecular weight of 244.30 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-phenoxy-2-propylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 80946591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).