1-((2-Pyrrolidin-1-yl)ethyl)uracil

C10H15N3O2 — CID 49845374

IUPAC1-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione
SMILESC1CCN(C1)CCN2C=CC(=O)NC2=O
InChIInChI=1S/C10H15N3O2/c14-9-3-6-13(10(15)11-9)8-7-12-4-1-2-5-12/h3,6H,1-2,4-5,7-8H2,(H,11,14,15)
InChIKeyWKIGBLAGQCDFDW-UHFFFAOYSA-N
MW209.24 g/mol
LogP-0.30
Rot. Bonds3

About 1-((2-Pyrrolidin-1-yl)ethyl)uracil

1-((2-Pyrrolidin-1-yl)ethyl)uracil (PubChem CID 49845374) has the molecular formula C10H15N3O2 and a molecular weight of 209.24 g/mol. Its IUPAC name is 1-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name1-((2-Pyrrolidin-1-yl)ethyl)uracil
PubChem CID49845374
Molecular FormulaC10H15N3O2
Molecular Weight209.24 g/mol
Exact Mass209.12
IUPAC Name1-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione
SMILESC1CCN(C1)CCN2C=CC(=O)NC2=O
InChIInChI=1S/C10H15N3O2/c14-9-3-6-13(10(15)11-9)8-7-12-4-1-2-5-12/h3,6H,1-2,4-5,7-8H2,(H,11,14,15)
InChIKeyWKIGBLAGQCDFDW-UHFFFAOYSA-N
XLogP-0.30
TPSA52.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity295

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-((2-Pyrrolidine-1-yl)-ethyl)uracil
CID 49845542
3-Butyluracil
CID 73265
N-butyl-2,4-dioxopyrimidine-1-carboxamide
CID 71655044
1-Butylpyrimidine-2,4(1h,3h)-dione
CID 244328
3-methyl-6-pyrrolidin-1-yl-1H-pyrimidine-2,4-dione
CID 386639
2,4-dioxo-N-propyl-1H-pyrimidine-3-carboxamide
CID 10241815
1-((3-Pyrrolidin-1-yl)propyl)uracil
CID 49845375
1-((4-Pyrrolidine-1-yl)-butyl)uracil
CID 49845539
1-propylpyrimidine-2,4(1H,3H)-dione
CID 250718
1-Acryloylimidazolidin-2-one
CID 14273533
3-Aminopropyluracil
CID 84021582
2-(2,4-dioxopyrimidin-1-yl)-N-propylacetamide
CID 30662441

Frequently Asked Questions

What is the IUPAC name of 1-((2-Pyrrolidin-1-yl)ethyl)uracil?
The IUPAC name of 1-((2-Pyrrolidin-1-yl)ethyl)uracil (CID 49845374) is 1-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-dione.
What is the SMILES notation for 1-((2-Pyrrolidin-1-yl)ethyl)uracil?
The canonical SMILES for 1-((2-Pyrrolidin-1-yl)ethyl)uracil is C1CCN(C1)CCN2C=CC(=O)NC2=O.
What is the InChIKey of 1-((2-Pyrrolidin-1-yl)ethyl)uracil?
The InChIKey is WKIGBLAGQCDFDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c14-9-3-6-13(10(15)11-9)8-7-12-4-1-2-5-12/h3,6H,1-2,4-5,7-8H2,(H,11,14,15).
What are the key properties of 1-((2-Pyrrolidin-1-yl)ethyl)uracil?
1-((2-Pyrrolidin-1-yl)ethyl)uracil has a molecular weight of 209.24 g/mol, XLogP of -0.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-((2-Pyrrolidin-1-yl)ethyl)uracil is sourced from PubChem (CID 49845374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).