N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide

C10H11N5O3 — CID 113433788

IUPACN-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide
SMILESCc1[nH]nc(NC(=O)c2cc(=O)[nH]c(=O)[nH]2)c1C
InChIInChI=1S/C10H11N5O3/c1-4-5(2)14-15-8(4)13-9(17)6-3-7(16)12-10(18)11-6/h3H,1-2H3,(H2,11,12,16,18)(H2,13,14,15,17)
InChIKeyBMFFTVSITLSWNM-UHFFFAOYSA-N
MW249.23 g/mol
LogP-0.34
Rot. Bonds2

About N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide

N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide (PubChem CID 113433788) has the molecular formula C10H11N5O3 and a molecular weight of 249.23 g/mol. Its IUPAC name is N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide
PubChem CID113433788
Molecular FormulaC10H11N5O3
Molecular Weight249.23 g/mol
Exact Mass249.09
IUPAC NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide
SMILESCc1[nH]nc(NC(=O)c2cc(=O)[nH]c(=O)[nH]2)c1C
InChIInChI=1S/C10H11N5O3/c1-4-5(2)14-15-8(4)13-9(17)6-3-7(16)12-10(18)11-6/h3H,1-2H3,(H2,11,12,16,18)(H2,13,14,15,17)
InChIKeyBMFFTVSITLSWNM-UHFFFAOYSA-N
XLogP-0.34
TPSA123.50 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.23
LogP ≤ 5-0.34
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide (CID 113433788) is N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide.
What is the SMILES notation for N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The canonical SMILES for N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide is Cc1[nH]nc(NC(=O)c2cc(=O)[nH]c(=O)[nH]2)c1C.
What is the InChIKey of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The InChIKey is BMFFTVSITLSWNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O3/c1-4-5(2)14-15-8(4)13-9(17)6-3-7(16)12-10(18)11-6/h3H,1-2H3,(H2,11,12,16,18)(H2,13,14,15,17).
What are the key properties of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide?
N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide has a molecular weight of 249.23 g/mol, XLogP of -0.34, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1H-pyrazol-3-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide is sourced from PubChem (CID 113433788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).