2-(1-ethoxyethyl)pyrimidin-5-amine

C8H13N3O — CID 64539638

IUPAC2-(1-ethoxyethyl)pyrimidin-5-amine
SMILESCCOC(C)c1ncc(N)cn1
InChIInChI=1S/C8H13N3O/c1-3-12-6(2)8-10-4-7(9)5-11-8/h4-6H,3,9H2,1-2H3
InChIKeyYPFSHYKVRANMLV-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.16
Rot. Bonds3

About 2-(1-ethoxyethyl)pyrimidin-5-amine

2-(1-ethoxyethyl)pyrimidin-5-amine (PubChem CID 64539638) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 2-(1-ethoxyethyl)pyrimidin-5-amine.

Molecular Properties

Compound Name2-(1-ethoxyethyl)pyrimidin-5-amine
PubChem CID64539638
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name2-(1-ethoxyethyl)pyrimidin-5-amine
SMILESCCOC(C)c1ncc(N)cn1
InChIInChI=1S/C8H13N3O/c1-3-12-6(2)8-10-4-7(9)5-11-8/h4-6H,3,9H2,1-2H3
InChIKeyYPFSHYKVRANMLV-UHFFFAOYSA-N
XLogP1.16
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-ethoxyethyl)pyrimidin-5-amine?
The IUPAC name of 2-(1-ethoxyethyl)pyrimidin-5-amine (CID 64539638) is 2-(1-ethoxyethyl)pyrimidin-5-amine.
What is the SMILES notation for 2-(1-ethoxyethyl)pyrimidin-5-amine?
The canonical SMILES for 2-(1-ethoxyethyl)pyrimidin-5-amine is CCOC(C)c1ncc(N)cn1.
What is the InChIKey of 2-(1-ethoxyethyl)pyrimidin-5-amine?
The InChIKey is YPFSHYKVRANMLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-3-12-6(2)8-10-4-7(9)5-11-8/h4-6H,3,9H2,1-2H3.
What are the key properties of 2-(1-ethoxyethyl)pyrimidin-5-amine?
2-(1-ethoxyethyl)pyrimidin-5-amine has a molecular weight of 167.21 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethoxyethyl)pyrimidin-5-amine is sourced from PubChem (CID 64539638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).