2-methyl-6-oxo-1H-pyrimidine-5-carboxamide

C6H7N3O2 — CID 53426734

IUPAC2-methyl-6-oxo-1H-pyrimidine-5-carboxamide
SMILESCc1ncc(C(N)=O)c(=O)[nH]1
InChIInChI=1S/C6H7N3O2/c1-3-8-2-4(5(7)10)6(11)9-3/h2H,1H3,(H2,7,10)(H,8,9,11)
InChIKeyPIKGLDBZGVKZKB-UHFFFAOYSA-N
MW153.14 g/mol
LogP-0.82
Rot. Bonds1

About 2-methyl-6-oxo-1H-pyrimidine-5-carboxamide

2-methyl-6-oxo-1H-pyrimidine-5-carboxamide (PubChem CID 53426734) has the molecular formula C6H7N3O2 and a molecular weight of 153.14 g/mol. Its IUPAC name is 2-methyl-6-oxo-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-methyl-6-oxo-1H-pyrimidine-5-carboxamide
PubChem CID53426734
Molecular FormulaC6H7N3O2
Molecular Weight153.14 g/mol
Exact Mass153.05
IUPAC Name2-methyl-6-oxo-1H-pyrimidine-5-carboxamide
SMILESCc1ncc(C(N)=O)c(=O)[nH]1
InChIInChI=1S/C6H7N3O2/c1-3-8-2-4(5(7)10)6(11)9-3/h2H,1H3,(H2,7,10)(H,8,9,11)
InChIKeyPIKGLDBZGVKZKB-UHFFFAOYSA-N
XLogP-0.82
TPSA88.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.14
LogP ≤ 5-0.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-oxo-1H-pyrimidine-5-carboxamide?
The IUPAC name of 2-methyl-6-oxo-1H-pyrimidine-5-carboxamide (CID 53426734) is 2-methyl-6-oxo-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for 2-methyl-6-oxo-1H-pyrimidine-5-carboxamide?
The canonical SMILES for 2-methyl-6-oxo-1H-pyrimidine-5-carboxamide is Cc1ncc(C(N)=O)c(=O)[nH]1.
What is the InChIKey of 2-methyl-6-oxo-1H-pyrimidine-5-carboxamide?
The InChIKey is PIKGLDBZGVKZKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O2/c1-3-8-2-4(5(7)10)6(11)9-3/h2H,1H3,(H2,7,10)(H,8,9,11).
What are the key properties of 2-methyl-6-oxo-1H-pyrimidine-5-carboxamide?
2-methyl-6-oxo-1H-pyrimidine-5-carboxamide has a molecular weight of 153.14 g/mol, XLogP of -0.82, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-oxo-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 53426734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).