5-ethyl-1,4-dihydropyrimidin-2-amine

C6H11N3 — CID 89374650

IUPAC5-ethyl-1,4-dihydropyrimidin-2-amine
SMILESCCC1=CNC(N)=NC1
InChIInChI=1S/C6H11N3/c1-2-5-3-8-6(7)9-4-5/h3H,2,4H2,1H3,(H3,7,8,9)
InChIKeyBSFDURLQIRNIIE-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.20
Rot. Bonds1

About 5-ethyl-1,4-dihydropyrimidin-2-amine

5-ethyl-1,4-dihydropyrimidin-2-amine (PubChem CID 89374650) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 5-ethyl-1,4-dihydropyrimidin-2-amine.

Molecular Properties

Compound Name5-ethyl-1,4-dihydropyrimidin-2-amine
PubChem CID89374650
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name5-ethyl-1,4-dihydropyrimidin-2-amine
SMILESCCC1=CNC(N)=NC1
InChIInChI=1S/C6H11N3/c1-2-5-3-8-6(7)9-4-5/h3H,2,4H2,1H3,(H3,7,8,9)
InChIKeyBSFDURLQIRNIIE-UHFFFAOYSA-N
XLogP0.20
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1,4-dihydropyrimidin-2-amine?
The IUPAC name of 5-ethyl-1,4-dihydropyrimidin-2-amine (CID 89374650) is 5-ethyl-1,4-dihydropyrimidin-2-amine.
What is the SMILES notation for 5-ethyl-1,4-dihydropyrimidin-2-amine?
The canonical SMILES for 5-ethyl-1,4-dihydropyrimidin-2-amine is CCC1=CNC(N)=NC1.
What is the InChIKey of 5-ethyl-1,4-dihydropyrimidin-2-amine?
The InChIKey is BSFDURLQIRNIIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-2-5-3-8-6(7)9-4-5/h3H,2,4H2,1H3,(H3,7,8,9).
What are the key properties of 5-ethyl-1,4-dihydropyrimidin-2-amine?
5-ethyl-1,4-dihydropyrimidin-2-amine has a molecular weight of 125.17 g/mol, XLogP of 0.20, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1,4-dihydropyrimidin-2-amine is sourced from PubChem (CID 89374650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).