N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide

C10H14N4O3 — CID 11694370

IUPACN-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide
SMILESCCNC(=O)N1CCc2[nH]c(=O)[nH]c(=O)c2C1
InChIInChI=1S/C10H14N4O3/c1-2-11-10(17)14-4-3-7-6(5-14)8(15)13-9(16)12-7/h2-5H2,1H3,(H,11,17)(H2,12,13,15,16)
InChIKeyTZFBGNUGZGGLNH-UHFFFAOYSA-N
MW238.25 g/mol
LogP-0.85
Rot. Bonds1

About N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide

N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide (PubChem CID 11694370) has the molecular formula C10H14N4O3 and a molecular weight of 238.25 g/mol. Its IUPAC name is N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide
PubChem CID11694370
Molecular FormulaC10H14N4O3
Molecular Weight238.25 g/mol
Exact Mass238.11
IUPAC NameN-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide
SMILESCCNC(=O)N1CCc2[nH]c(=O)[nH]c(=O)c2C1
InChIInChI=1S/C10H14N4O3/c1-2-11-10(17)14-4-3-7-6(5-14)8(15)13-9(16)12-7/h2-5H2,1H3,(H,11,17)(H2,12,13,15,16)
InChIKeyTZFBGNUGZGGLNH-UHFFFAOYSA-N
XLogP-0.85
TPSA98.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 5-0.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide?
The IUPAC name of N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide (CID 11694370) is N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide.
What is the SMILES notation for N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide?
The canonical SMILES for N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide is CCNC(=O)N1CCc2[nH]c(=O)[nH]c(=O)c2C1.
What is the InChIKey of N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide?
The InChIKey is TZFBGNUGZGGLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O3/c1-2-11-10(17)14-4-3-7-6(5-14)8(15)13-9(16)12-7/h2-5H2,1H3,(H,11,17)(H2,12,13,15,16).
What are the key properties of N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide?
N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide has a molecular weight of 238.25 g/mol, XLogP of -0.85, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 11694370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).