2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide

C5H7N3O2 — CID 45084148

IUPAC2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
SMILESNC(=O)C1=CNC(=O)NC1
InChIInChI=1S/C5H7N3O2/c6-4(9)3-1-7-5(10)8-2-3/h1H,2H2,(H2,6,9)(H2,7,8,10)
InChIKeyYXHWZJTXHQIKQO-UHFFFAOYSA-N
MW141.13 g/mol
LogP-1.33
Rot. Bonds1

About 2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide

2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide (PubChem CID 45084148) has the molecular formula C5H7N3O2 and a molecular weight of 141.13 g/mol. Its IUPAC name is 2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
PubChem CID45084148
Molecular FormulaC5H7N3O2
Molecular Weight141.13 g/mol
Exact Mass141.05
IUPAC Name2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
SMILESNC(=O)C1=CNC(=O)NC1
InChIInChI=1S/C5H7N3O2/c6-4(9)3-1-7-5(10)8-2-3/h1H,2H2,(H2,6,9)(H2,7,8,10)
InChIKeyYXHWZJTXHQIKQO-UHFFFAOYSA-N
XLogP-1.33
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.13
LogP ≤ 5-1.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide?
The IUPAC name of 2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide (CID 45084148) is 2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for 2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide?
The canonical SMILES for 2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide is NC(=O)C1=CNC(=O)NC1.
What is the InChIKey of 2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide?
The InChIKey is YXHWZJTXHQIKQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O2/c6-4(9)3-1-7-5(10)8-2-3/h1H,2H2,(H2,6,9)(H2,7,8,10).
What are the key properties of 2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide?
2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide has a molecular weight of 141.13 g/mol, XLogP of -1.33, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 45084148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).