2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine

C15H19N3O2 — CID 115915936

IUPAC2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine
SMILESCCCOCCOc1cc(N)nc(-c2ccccc2)n1
InChIInChI=1S/C15H19N3O2/c1-2-8-19-9-10-20-14-11-13(16)17-15(18-14)12-6-4-3-5-7-12/h3-7,11H,2,8-10H2,1H3,(H2,16,17,18)
InChIKeyKDBJDNYBJXZPBB-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.53
Rot. Bonds7

About 2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine

2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine (PubChem CID 115915936) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine.

Molecular Properties

Compound Name2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine
PubChem CID115915936
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine
SMILESCCCOCCOc1cc(N)nc(-c2ccccc2)n1
InChIInChI=1S/C15H19N3O2/c1-2-8-19-9-10-20-14-11-13(16)17-15(18-14)12-6-4-3-5-7-12/h3-7,11H,2,8-10H2,1H3,(H2,16,17,18)
InChIKeyKDBJDNYBJXZPBB-UHFFFAOYSA-N
XLogP2.53
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

[2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-yl]hydrazine
CID 115916312
6-ethoxy-2-phenylpyrimidin-4-amine
CID 14242675
6-(3,3-dimethylbutoxy)-2-phenylpyrimidin-4-amine
CID 115915949
2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine
CID 80876486
[6-(2-ethoxyethoxy)-2-phenylpyrimidin-4-yl]hydrazine
CID 115916297
2-phenyl-6-prop-2-enoxypyrimidin-4-amine
CID 112559862
6-[(E)-but-2-enoxy]-2-phenylpyrimidin-4-amine
CID 112559904
6-butan-2-yloxy-2-phenylpyrimidin-4-amine
CID 112559900
2-phenyl-4-[4-(2-phenyl-6-propylpyrimidin-4-yl)oxybutoxy]-6-propylpyrimidine
CID 74538841
6-phenoxy-2-phenylpyrimidin-4-amine
CID 115915894
4-phenyl-6-propoxypyrimidin-2-amine
CID 46173611
6-butoxy-N-methyl-2-phenylpyrimidin-4-amine
CID 112559898

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine?
The IUPAC name of 2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine (CID 115915936) is 2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine.
What is the SMILES notation for 2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine?
The canonical SMILES for 2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine is CCCOCCOc1cc(N)nc(-c2ccccc2)n1.
What is the InChIKey of 2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine?
The InChIKey is KDBJDNYBJXZPBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-2-8-19-9-10-20-14-11-13(16)17-15(18-14)12-6-4-3-5-7-12/h3-7,11H,2,8-10H2,1H3,(H2,16,17,18).
What are the key properties of 2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine?
2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine has a molecular weight of 273.34 g/mol, XLogP of 2.53, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-amine is sourced from PubChem (CID 115915936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).