4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine

C7H10N3P — CID 143899691

IUPAC4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine
SMILESC=Cc1cc(C)nc(NP)n1
InChIInChI=1S/C7H10N3P/c1-3-6-4-5(2)8-7(9-6)10-11/h3-4H,1,11H2,2H3,(H,8,9,10)
InChIKeyVCLTYZUXEHVKGE-UHFFFAOYSA-N
MW167.15 g/mol
LogP1.63
Rot. Bonds2

About 4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine

4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine (PubChem CID 143899691) has the molecular formula C7H10N3P and a molecular weight of 167.15 g/mol. Its IUPAC name is 4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine.

Molecular Properties

Compound Name4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine
PubChem CID143899691
Molecular FormulaC7H10N3P
Molecular Weight167.15 g/mol
Exact Mass167.06
IUPAC Name4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine
SMILESC=Cc1cc(C)nc(NP)n1
InChIInChI=1S/C7H10N3P/c1-3-6-4-5(2)8-7(9-6)10-11/h3-4H,1,11H2,2H3,(H,8,9,10)
InChIKeyVCLTYZUXEHVKGE-UHFFFAOYSA-N
XLogP1.63
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.15
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine?
The IUPAC name of 4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine (CID 143899691) is 4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine.
What is the SMILES notation for 4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine?
The canonical SMILES for 4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine is C=Cc1cc(C)nc(NP)n1.
What is the InChIKey of 4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine?
The InChIKey is VCLTYZUXEHVKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N3P/c1-3-6-4-5(2)8-7(9-6)10-11/h3-4H,1,11H2,2H3,(H,8,9,10).
What are the key properties of 4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine?
4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine has a molecular weight of 167.15 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-6-methyl-N-phosphanylpyrimidin-2-amine is sourced from PubChem (CID 143899691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).