3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide

C10H15N3O2 — CID 116618385

IUPAC3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCn1cccnc1=O
InChIInChI=1S/C10H15N3O2/c1-8(2)12-9(14)4-7-13-6-3-5-11-10(13)15/h3,5-6,8H,4,7H2,1-2H3,(H,12,14)
InChIKeyFMTKPECILSMUEE-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.16
Rot. Bonds4

About 3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide

3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide (PubChem CID 116618385) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide
PubChem CID116618385
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCn1cccnc1=O
InChIInChI=1S/C10H15N3O2/c1-8(2)12-9(14)4-7-13-6-3-5-11-10(13)15/h3,5-6,8H,4,7H2,1-2H3,(H,12,14)
InChIKeyFMTKPECILSMUEE-UHFFFAOYSA-N
XLogP0.16
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide?
The IUPAC name of 3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide (CID 116618385) is 3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide is CC(C)NC(=O)CCn1cccnc1=O.
What is the InChIKey of 3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide?
The InChIKey is FMTKPECILSMUEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-8(2)12-9(14)4-7-13-6-3-5-11-10(13)15/h3,5-6,8H,4,7H2,1-2H3,(H,12,14).
What are the key properties of 3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide?
3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide has a molecular weight of 209.25 g/mol, XLogP of 0.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxopyrimidin-1-yl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 116618385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).