N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide

C10H12N4O3 — CID 43594393

IUPACN-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide
SMILESO=C(NC1C2CNCC21)c1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C10H12N4O3/c15-7-1-6(12-10(17)13-7)9(16)14-8-4-2-11-3-5(4)8/h1,4-5,8,11H,2-3H2,(H,14,16)(H2,12,13,15,17)
InChIKeyBEFWHFLUWXSIGH-UHFFFAOYSA-N
MW236.23 g/mol
LogP-1.99
Rot. Bonds2

About N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide

N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide (PubChem CID 43594393) has the molecular formula C10H12N4O3 and a molecular weight of 236.23 g/mol. Its IUPAC name is N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide
PubChem CID43594393
Molecular FormulaC10H12N4O3
Molecular Weight236.23 g/mol
Exact Mass236.09
IUPAC NameN-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide
SMILESO=C(NC1C2CNCC21)c1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C10H12N4O3/c15-7-1-6(12-10(17)13-7)9(16)14-8-4-2-11-3-5(4)8/h1,4-5,8,11H,2-3H2,(H,14,16)(H2,12,13,15,17)
InChIKeyBEFWHFLUWXSIGH-UHFFFAOYSA-N
XLogP-1.99
TPSA106.85 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.23
LogP ≤ 5-1.99
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide with MolForge

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Related Compounds

1,3-Dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione
CID 56796823
2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide
CID 43345784
6-(4-aminopiperidine-1-carbonyl)-1H-pyrimidine-2,4-dione
CID 43556193
N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 43594249
N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide
CID 43602147
6-[4-(methylaminomethyl)piperidine-1-carbonyl]-1H-pyrimidine-2,4-dione
CID 55176062
N-(2-amino-2-oxoethyl)-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide
CID 60800875
N-ethyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide
CID 60805228
2,4-dioxo-N-piperidin-4-yl-N-propyl-1H-pyrimidine-6-carboxamide
CID 60807273
6-[[(1-Cyclopropylpyrrolidin-3-yl)methylamino]methyl]-1,3-dimethylpyrimidine-2,4-dione
CID 60976198
6-(3-pyrrolidin-2-ylpiperidine-1-carbonyl)-1H-pyrimidine-2,4-dione
CID 60979497
6-[3-(methylaminomethyl)piperidine-1-carbonyl]-1H-pyrimidine-2,4-dione
CID 61205458

Frequently Asked Questions

What is the IUPAC name of N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The IUPAC name of N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide (CID 43594393) is N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide.
What is the SMILES notation for N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The canonical SMILES for N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide is O=C(NC1C2CNCC21)c1cc(=O)[nH]c(=O)[nH]1.
What is the InChIKey of N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide?
The InChIKey is BEFWHFLUWXSIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O3/c15-7-1-6(12-10(17)13-7)9(16)14-8-4-2-11-3-5(4)8/h1,4-5,8,11H,2-3H2,(H,14,16)(H2,12,13,15,17).
What are the key properties of N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide?
N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide has a molecular weight of 236.23 g/mol, XLogP of -1.99, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-azabicyclo[3.1.0]hexan-6-yl)-2,4-dioxo-1H-pyrimidine-6-carboxamide is sourced from PubChem (CID 43594393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).