2-(2-propylpyrimidin-4-yl)ethanamine

C9H15N3 — CID 62744687

IUPAC2-(2-propylpyrimidin-4-yl)ethanamine
SMILESCCCc1nccc(CCN)n1
InChIInChI=1S/C9H15N3/c1-2-3-9-11-7-5-8(12-9)4-6-10/h5,7H,2-4,6,10H2,1H3
InChIKeyXPLPJMBFSYGOFK-UHFFFAOYSA-N
MW165.24 g/mol
LogP0.93
Rot. Bonds4

About 2-(2-propylpyrimidin-4-yl)ethanamine

2-(2-propylpyrimidin-4-yl)ethanamine (PubChem CID 62744687) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-(2-propylpyrimidin-4-yl)ethanamine.

Molecular Properties

Compound Name2-(2-propylpyrimidin-4-yl)ethanamine
PubChem CID62744687
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name2-(2-propylpyrimidin-4-yl)ethanamine
SMILESCCCc1nccc(CCN)n1
InChIInChI=1S/C9H15N3/c1-2-3-9-11-7-5-8(12-9)4-6-10/h5,7H,2-4,6,10H2,1H3
InChIKeyXPLPJMBFSYGOFK-UHFFFAOYSA-N
XLogP0.93
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-propylpyrimidin-4-yl)ethanamine?
The IUPAC name of 2-(2-propylpyrimidin-4-yl)ethanamine (CID 62744687) is 2-(2-propylpyrimidin-4-yl)ethanamine.
What is the SMILES notation for 2-(2-propylpyrimidin-4-yl)ethanamine?
The canonical SMILES for 2-(2-propylpyrimidin-4-yl)ethanamine is CCCc1nccc(CCN)n1.
What is the InChIKey of 2-(2-propylpyrimidin-4-yl)ethanamine?
The InChIKey is XPLPJMBFSYGOFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-2-3-9-11-7-5-8(12-9)4-6-10/h5,7H,2-4,6,10H2,1H3.
What are the key properties of 2-(2-propylpyrimidin-4-yl)ethanamine?
2-(2-propylpyrimidin-4-yl)ethanamine has a molecular weight of 165.24 g/mol, XLogP of 0.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propylpyrimidin-4-yl)ethanamine is sourced from PubChem (CID 62744687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).