2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide

C12H17N5O2 — CID 72876341

IUPAC2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide
SMILESCCc1ncc(C(=O)NCCN2CCNC2=O)cn1
InChIInChI=1S/C12H17N5O2/c1-2-10-15-7-9(8-16-10)11(18)13-3-5-17-6-4-14-12(17)19/h7-8H,2-6H2,1H3,(H,13,18)(H,14,19)
InChIKeyNQEDOEDIJNNOED-UHFFFAOYSA-N
MW263.30 g/mol
LogP-0.21
Rot. Bonds5

About 2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide

2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide (PubChem CID 72876341) has the molecular formula C12H17N5O2 and a molecular weight of 263.30 g/mol. Its IUPAC name is 2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide
PubChem CID72876341
Molecular FormulaC12H17N5O2
Molecular Weight263.30 g/mol
Exact Mass263.14
IUPAC Name2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide
SMILESCCc1ncc(C(=O)NCCN2CCNC2=O)cn1
InChIInChI=1S/C12H17N5O2/c1-2-10-15-7-9(8-16-10)11(18)13-3-5-17-6-4-14-12(17)19/h7-8H,2-6H2,1H3,(H,13,18)(H,14,19)
InChIKeyNQEDOEDIJNNOED-UHFFFAOYSA-N
XLogP-0.21
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide?
The IUPAC name of 2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide (CID 72876341) is 2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide.
What is the SMILES notation for 2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide?
The canonical SMILES for 2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide is CCc1ncc(C(=O)NCCN2CCNC2=O)cn1.
What is the InChIKey of 2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide?
The InChIKey is NQEDOEDIJNNOED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O2/c1-2-10-15-7-9(8-16-10)11(18)13-3-5-17-6-4-14-12(17)19/h7-8H,2-6H2,1H3,(H,13,18)(H,14,19).
What are the key properties of 2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide?
2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide has a molecular weight of 263.30 g/mol, XLogP of -0.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidine-5-carboxamide is sourced from PubChem (CID 72876341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).