N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide

C10H15N3O3 — CID 30789724

IUPACN-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
SMILESCCNC(=O)CCc1c(C)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C10H15N3O3/c1-3-11-8(14)5-4-7-6(2)12-10(16)13-9(7)15/h3-5H2,1-2H3,(H,11,14)(H2,12,13,15,16)
InChIKeyRBNRMQKJXQMHKB-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.56
Rot. Bonds4

About N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide

N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide (PubChem CID 30789724) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
PubChem CID30789724
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC NameN-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
SMILESCCNC(=O)CCc1c(C)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C10H15N3O3/c1-3-11-8(14)5-4-7-6(2)12-10(16)13-9(7)15/h3-5H2,1-2H3,(H,11,14)(H2,12,13,15,16)
InChIKeyRBNRMQKJXQMHKB-UHFFFAOYSA-N
XLogP-0.56
TPSA94.82 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide?
The IUPAC name of N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide (CID 30789724) is N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide.
What is the SMILES notation for N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide?
The canonical SMILES for N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide is CCNC(=O)CCc1c(C)[nH]c(=O)[nH]c1=O.
What is the InChIKey of N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide?
The InChIKey is RBNRMQKJXQMHKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-3-11-8(14)5-4-7-6(2)12-10(16)13-9(7)15/h3-5H2,1-2H3,(H,11,14)(H2,12,13,15,16).
What are the key properties of N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide?
N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide has a molecular weight of 225.25 g/mol, XLogP of -0.56, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide is sourced from PubChem (CID 30789724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).