N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide

C6H7N3O2 — CID 54101360

IUPACN-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide
SMILESCc1cnc(NC=O)c(=O)[nH]1
InChIInChI=1S/C6H7N3O2/c1-4-2-7-5(8-3-10)6(11)9-4/h2-3H,1H3,(H,9,11)(H,7,8,10)
InChIKeyNASLGIBJVKPNJX-UHFFFAOYSA-N
MW153.14 g/mol
LogP-0.35
Rot. Bonds2

About N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide

N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide (PubChem CID 54101360) has the molecular formula C6H7N3O2 and a molecular weight of 153.14 g/mol. Its IUPAC name is N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide.

Molecular Properties

Compound NameN-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide
PubChem CID54101360
Molecular FormulaC6H7N3O2
Molecular Weight153.14 g/mol
Exact Mass153.05
IUPAC NameN-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide
SMILESCc1cnc(NC=O)c(=O)[nH]1
InChIInChI=1S/C6H7N3O2/c1-4-2-7-5(8-3-10)6(11)9-4/h2-3H,1H3,(H,9,11)(H,7,8,10)
InChIKeyNASLGIBJVKPNJX-UHFFFAOYSA-N
XLogP-0.35
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.14
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide?
The IUPAC name of N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide (CID 54101360) is N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide.
What is the SMILES notation for N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide?
The canonical SMILES for N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide is Cc1cnc(NC=O)c(=O)[nH]1.
What is the InChIKey of N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide?
The InChIKey is NASLGIBJVKPNJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O2/c1-4-2-7-5(8-3-10)6(11)9-4/h2-3H,1H3,(H,9,11)(H,7,8,10).
What are the key properties of N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide?
N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide has a molecular weight of 153.14 g/mol, XLogP of -0.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-oxo-1H-pyrazin-3-yl)formamide is sourced from PubChem (CID 54101360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).