N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide

C13H19N3O3 — CID 54994648

IUPACN-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide
SMILESO=C(Cn1cccnc1=O)N(CCO)C1CCCC1
InChIInChI=1S/C13H19N3O3/c17-9-8-16(11-4-1-2-5-11)12(18)10-15-7-3-6-14-13(15)19/h3,6-7,11,17H,1-2,4-5,8-10H2
InChIKeyVUEPGCFEFIBLLQ-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.01
Rot. Bonds5

About N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide

N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide (PubChem CID 54994648) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide
PubChem CID54994648
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide
SMILESO=C(Cn1cccnc1=O)N(CCO)C1CCCC1
InChIInChI=1S/C13H19N3O3/c17-9-8-16(11-4-1-2-5-11)12(18)10-15-7-3-6-14-13(15)19/h3,6-7,11,17H,1-2,4-5,8-10H2
InChIKeyVUEPGCFEFIBLLQ-UHFFFAOYSA-N
XLogP0.01
TPSA75.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide (CID 54994648) is N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide is O=C(Cn1cccnc1=O)N(CCO)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
The InChIKey is VUEPGCFEFIBLLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c17-9-8-16(11-4-1-2-5-11)12(18)10-15-7-3-6-14-13(15)19/h3,6-7,11,17H,1-2,4-5,8-10H2.
What are the key properties of N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide?
N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide has a molecular weight of 265.31 g/mol, XLogP of 0.01, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 54994648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).