N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide

C7H9N3O3 — CID 60637058

IUPACN,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide
SMILESCN(C)C(=O)c1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C7H9N3O3/c1-10(2)6(12)4-3-5(11)9-7(13)8-4/h3H,1-2H3,(H2,8,9,11,13)
InChIKeyVTCIMOUIYHJWAL-UHFFFAOYSA-N
MW183.17 g/mol
LogP-1.24
Rot. Bonds1

About N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide

N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide (PubChem CID 60637058) has the molecular formula C7H9N3O3 and a molecular weight of 183.17 g/mol. Its IUPAC name is N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide
PubChem CID60637058
Molecular FormulaC7H9N3O3
Molecular Weight183.17 g/mol
Exact Mass183.06
IUPAC NameN,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide
SMILESCN(C)C(=O)c1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C7H9N3O3/c1-10(2)6(12)4-3-5(11)9-7(13)8-4/h3H,1-2H3,(H2,8,9,11,13)
InChIKeyVTCIMOUIYHJWAL-UHFFFAOYSA-N
XLogP-1.24
TPSA86.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 5-1.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The IUPAC name of N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide (CID 60637058) is N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide.
What is the SMILES notation for N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The canonical SMILES for N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide is CN(C)C(=O)c1cc(=O)[nH]c(=O)[nH]1.
What is the InChIKey of N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The InChIKey is VTCIMOUIYHJWAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O3/c1-10(2)6(12)4-3-5(11)9-7(13)8-4/h3H,1-2H3,(H2,8,9,11,13).
What are the key properties of N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide?
N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide has a molecular weight of 183.17 g/mol, XLogP of -1.24, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2,4-dioxo-1H-pyrimidine-6-carboxamide is sourced from PubChem (CID 60637058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).