6-prop-1-enylpyrimidin-4-amine

C7H9N3 — CID 174768910

IUPAC6-prop-1-enylpyrimidin-4-amine
SMILESCC=Cc1cc(N)ncn1
InChIInChI=1S/C7H9N3/c1-2-3-6-4-7(8)10-5-9-6/h2-5H,1H3,(H2,8,9,10)
InChIKeyDCQUIRUANHIFDC-UHFFFAOYSA-N
MW135.17 g/mol
LogP1.09
Rot. Bonds1

About 6-prop-1-enylpyrimidin-4-amine

6-prop-1-enylpyrimidin-4-amine (PubChem CID 174768910) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 6-prop-1-enylpyrimidin-4-amine.

Molecular Properties

Compound Name6-prop-1-enylpyrimidin-4-amine
PubChem CID174768910
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name6-prop-1-enylpyrimidin-4-amine
SMILESCC=Cc1cc(N)ncn1
InChIInChI=1S/C7H9N3/c1-2-3-6-4-7(8)10-5-9-6/h2-5H,1H3,(H2,8,9,10)
InChIKeyDCQUIRUANHIFDC-UHFFFAOYSA-N
XLogP1.09
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-prop-1-enylpyrimidin-4-amine?
The IUPAC name of 6-prop-1-enylpyrimidin-4-amine (CID 174768910) is 6-prop-1-enylpyrimidin-4-amine.
What is the SMILES notation for 6-prop-1-enylpyrimidin-4-amine?
The canonical SMILES for 6-prop-1-enylpyrimidin-4-amine is CC=Cc1cc(N)ncn1.
What is the InChIKey of 6-prop-1-enylpyrimidin-4-amine?
The InChIKey is DCQUIRUANHIFDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c1-2-3-6-4-7(8)10-5-9-6/h2-5H,1H3,(H2,8,9,10).
What are the key properties of 6-prop-1-enylpyrimidin-4-amine?
6-prop-1-enylpyrimidin-4-amine has a molecular weight of 135.17 g/mol, XLogP of 1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-prop-1-enylpyrimidin-4-amine is sourced from PubChem (CID 174768910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).