N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide

C10H13N3O3 — CID 136513269

IUPACN-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide
SMILESCN(C(=O)c1c[nH]c(=O)n(C)c1=O)C1CC1
InChIInChI=1S/C10H13N3O3/c1-12(6-3-4-6)8(14)7-5-11-10(16)13(2)9(7)15/h5-6H,3-4H2,1-2H3,(H,11,16)
InChIKeyQYBSHIADBFDJTF-UHFFFAOYSA-N
MW223.23 g/mol
LogP-0.69
Rot. Bonds2

About N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide

N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide (PubChem CID 136513269) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide
PubChem CID136513269
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC NameN-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide
SMILESCN(C(=O)c1c[nH]c(=O)n(C)c1=O)C1CC1
InChIInChI=1S/C10H13N3O3/c1-12(6-3-4-6)8(14)7-5-11-10(16)13(2)9(7)15/h5-6H,3-4H2,1-2H3,(H,11,16)
InChIKeyQYBSHIADBFDJTF-UHFFFAOYSA-N
XLogP-0.69
TPSA75.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 5-0.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-N,6-dimethyl-4-oxo-1H-pyridine-3-carboxamide
CID 103717557
N-cyclopropyl-N-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 103337372
N-(4-aminocyclohexyl)-N-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 114038609
5-(2,6-dimethylmorpholine-4-carbonyl)-3-methyl-1H-pyrimidine-2,4-dione
CID 121025206
N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-5-carboxamide
CID 43602104
3-methyl-5-[4-[methyl(pyrimidin-4-yl)amino]piperidine-1-carbonyl]-1H-pyrimidine-2,4-dione
CID 126888823
cis-(1R,3S)-3-[(3-methyl-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120678012
8-bromo-N-cyclopropyl-N-methyl-4-oxo-1H-quinoline-3-carboxamide
CID 56792763
N-(8-azabicyclo[3.2.1]octan-3-yl)-N,6-dimethyl-4-oxo-1H-pyridine-3-carboxamide
CID 103840422
N-butyl-3-methyl-2,4-dioxo-1H-pyrimidine-5-carboxamide
CID 121025190
5-[(2S)-2-[(1R)-1-aminoethyl]piperidine-1-carbonyl]-3-methyl-1H-pyrimidine-2,4-dione
CID 125120155
N-methyl-N-(1-methylpiperidin-4-yl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 110475007

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide?
The IUPAC name of N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide (CID 136513269) is N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide?
The canonical SMILES for N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide is CN(C(=O)c1c[nH]c(=O)n(C)c1=O)C1CC1.
What is the InChIKey of N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide?
The InChIKey is QYBSHIADBFDJTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c1-12(6-3-4-6)8(14)7-5-11-10(16)13(2)9(7)15/h5-6H,3-4H2,1-2H3,(H,11,16).
What are the key properties of N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide?
N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide has a molecular weight of 223.23 g/mol, XLogP of -0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N,3-dimethyl-2,4-dioxo-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 136513269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).