1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol

C10H16N4O2 — CID 106674454

IUPAC1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol
SMILESCCNc1cc(N2CC(O)C(O)C2)ncn1
InChIInChI=1S/C10H16N4O2/c1-2-11-9-3-10(13-6-12-9)14-4-7(15)8(16)5-14/h3,6-8,15-16H,2,4-5H2,1H3,(H,11,12,13)
InChIKeyHEJAIVYMMJLCAW-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.55
Rot. Bonds3

About 1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol

1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol (PubChem CID 106674454) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol.

Molecular Properties

Compound Name1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol
PubChem CID106674454
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol
SMILESCCNc1cc(N2CC(O)C(O)C2)ncn1
InChIInChI=1S/C10H16N4O2/c1-2-11-9-3-10(13-6-12-9)14-4-7(15)8(16)5-14/h3,6-8,15-16H,2,4-5H2,1H3,(H,11,12,13)
InChIKeyHEJAIVYMMJLCAW-UHFFFAOYSA-N
XLogP-0.55
TPSA81.51 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol with MolForge

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

Launch Full Analysis

Related Compounds

N-ethyl-6-(2-methylmorpholin-4-yl)pyrimidin-4-amine
CID 80764965
N-ethyl-6-(4-methylazepan-1-yl)pyrimidin-4-amine
CID 80834548
1-[6-(ethylamino)-2-propylpyrimidin-4-yl]pyrrolidine-3,4-diol
CID 106674486
N-ethyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 80757593
1-[6-(ethylamino)pyrimidin-4-yl]-N-methylpiperidine-4-carboxamide
CID 80799616
4-methyl-1-[6-(propylamino)pyrimidin-4-yl]piperidin-3-ol
CID 102971029
1-[6-(methylamino)pyrimidin-4-yl]azetidin-3-ol
CID 121206025
N-ethyl-6-(3-phenylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80822469
N-ethyl-6-(4-propylazepan-1-yl)pyrimidin-4-amine
CID 80837648
6-(2,6-dimethylmorpholin-4-yl)-N-propylpyrimidin-4-amine
CID 80764701
6-(2,5-dimethylpiperidin-1-yl)-N-ethylpyrimidin-4-amine
CID 80847112
1-[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]pyrrolidine-3,4-diol
CID 106674447

Frequently Asked Questions

What is the IUPAC name of 1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol?
The IUPAC name of 1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol (CID 106674454) is 1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol.
What is the SMILES notation for 1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol?
The canonical SMILES for 1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol is CCNc1cc(N2CC(O)C(O)C2)ncn1.
What is the InChIKey of 1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol?
The InChIKey is HEJAIVYMMJLCAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-2-11-9-3-10(13-6-12-9)14-4-7(15)8(16)5-14/h3,6-8,15-16H,2,4-5H2,1H3,(H,11,12,13).
What are the key properties of 1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol?
1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol has a molecular weight of 224.26 g/mol, XLogP of -0.55, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol is sourced from PubChem (CID 106674454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).