N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide

C10H13N3O3 — CID 903290

IUPACN-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide
SMILESCn1c(NC(=O)C2CC2)cc(=O)n(C)c1=O
InChIInChI=1S/C10H13N3O3/c1-12-7(11-9(15)6-3-4-6)5-8(14)13(2)10(12)16/h5-6H,3-4H2,1-2H3,(H,11,15)
InChIKeyJROMGBIKDMXXBQ-UHFFFAOYSA-N
MW223.23 g/mol
LogP-0.57
Rot. Bonds2

About N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide

N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide (PubChem CID 903290) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide
PubChem CID903290
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC NameN-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide
SMILESCn1c(NC(=O)C2CC2)cc(=O)n(C)c1=O
InChIInChI=1S/C10H13N3O3/c1-12-7(11-9(15)6-3-4-6)5-8(14)13(2)10(12)16/h5-6H,3-4H2,1-2H3,(H,11,15)
InChIKeyJROMGBIKDMXXBQ-UHFFFAOYSA-N
XLogP-0.57
TPSA73.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 5-0.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide?
The IUPAC name of N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide (CID 903290) is N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide is Cn1c(NC(=O)C2CC2)cc(=O)n(C)c1=O.
What is the InChIKey of N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide?
The InChIKey is JROMGBIKDMXXBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c1-12-7(11-9(15)6-3-4-6)5-8(14)13(2)10(12)16/h5-6H,3-4H2,1-2H3,(H,11,15).
What are the key properties of N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide?
N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide has a molecular weight of 223.23 g/mol, XLogP of -0.57, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)cyclopropanecarboxamide is sourced from PubChem (CID 903290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).