1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol

C10H16N4O — CID 80935425

IUPAC1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol
SMILESCCc1nc(N)cc(N2CCC(O)C2)n1
InChIInChI=1S/C10H16N4O/c1-2-9-12-8(11)5-10(13-9)14-4-3-7(15)6-14/h5,7,15H,2-4,6H2,1H3,(H2,11,12,13)
InChIKeyKZDJHXWROBBBQK-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.19
Rot. Bonds2

About 1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol

1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol (PubChem CID 80935425) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol
PubChem CID80935425
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol
SMILESCCc1nc(N)cc(N2CCC(O)C2)n1
InChIInChI=1S/C10H16N4O/c1-2-9-12-8(11)5-10(13-9)14-4-3-7(15)6-14/h5,7,15H,2-4,6H2,1H3,(H2,11,12,13)
InChIKeyKZDJHXWROBBBQK-UHFFFAOYSA-N
XLogP0.19
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol?
The IUPAC name of 1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol (CID 80935425) is 1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol.
What is the SMILES notation for 1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol?
The canonical SMILES for 1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol is CCc1nc(N)cc(N2CCC(O)C2)n1.
What is the InChIKey of 1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol?
The InChIKey is KZDJHXWROBBBQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-2-9-12-8(11)5-10(13-9)14-4-3-7(15)6-14/h5,7,15H,2-4,6H2,1H3,(H2,11,12,13).
What are the key properties of 1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol?
1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol has a molecular weight of 208.26 g/mol, XLogP of 0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-amino-2-ethylpyrimidin-4-yl)pyrrolidin-3-ol is sourced from PubChem (CID 80935425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).