5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine

C11H18N4 — CID 879100

IUPAC5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine
SMILESCCc1c(C)nc(N)nc1N1CCCC1
InChIInChI=1S/C11H18N4/c1-3-9-8(2)13-11(12)14-10(9)15-6-4-5-7-15/h3-7H2,1-2H3,(H2,12,13,14)
InChIKeyFPFBRHAVBCYLRI-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.53
Rot. Bonds2

About 5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine

5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine (PubChem CID 879100) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine.

Molecular Properties

Compound Name5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine
PubChem CID879100
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine
SMILESCCc1c(C)nc(N)nc1N1CCCC1
InChIInChI=1S/C11H18N4/c1-3-9-8(2)13-11(12)14-10(9)15-6-4-5-7-15/h3-7H2,1-2H3,(H2,12,13,14)
InChIKeyFPFBRHAVBCYLRI-UHFFFAOYSA-N
XLogP1.53
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine?
The IUPAC name of 5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine (CID 879100) is 5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine.
What is the SMILES notation for 5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine?
The canonical SMILES for 5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine is CCc1c(C)nc(N)nc1N1CCCC1.
What is the InChIKey of 5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine?
The InChIKey is FPFBRHAVBCYLRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-3-9-8(2)13-11(12)14-10(9)15-6-4-5-7-15/h3-7H2,1-2H3,(H2,12,13,14).
What are the key properties of 5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine?
5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine has a molecular weight of 206.29 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methyl-6-pyrrolidin-1-ylpyrimidin-2-amine is sourced from PubChem (CID 879100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).