N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide

C6H7N3O3 — CID 135968250

IUPACN-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide
SMILESCOc1nc(NC=O)cc(=O)[nH]1
InChIInChI=1S/C6H7N3O3/c1-12-6-8-4(7-3-10)2-5(11)9-6/h2-3H,1H3,(H2,7,8,9,10,11)
InChIKeyLFIUZWHAVGTIQT-UHFFFAOYSA-N
MW169.14 g/mol
LogP-0.65
Rot. Bonds3

About N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide

N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide (PubChem CID 135968250) has the molecular formula C6H7N3O3 and a molecular weight of 169.14 g/mol. Its IUPAC name is N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide.

Molecular Properties

Compound NameN-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide
PubChem CID135968250
Molecular FormulaC6H7N3O3
Molecular Weight169.14 g/mol
Exact Mass169.05
IUPAC NameN-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide
SMILESCOc1nc(NC=O)cc(=O)[nH]1
InChIInChI=1S/C6H7N3O3/c1-12-6-8-4(7-3-10)2-5(11)9-6/h2-3H,1H3,(H2,7,8,9,10,11)
InChIKeyLFIUZWHAVGTIQT-UHFFFAOYSA-N
XLogP-0.65
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.14
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-Amino-2-methoxy-3,4-dihydropyrimidin-4-one
CID 135404214
2-Amino-6-(methylamino)pyrimidin-4-ol
CID 135577492
2-Amino-4-hydroxy-6-methoxypyrimidine
CID 1532133
6-Methoxy-4-1H-pyrimidinone
CID 3770663
N-(2-methylsulfanyl-6-oxo-1H-pyrimidin-4-yl)formamide
CID 135968262
N-(2-methoxy-1-methyl-6-oxopyrimidin-4-yl)acetamide
CID 839271
N-(2-methoxy-1-methyl-6-oxopyrimidin-4-yl)formamide
CID 54612984
[4-(methylamino)-6-oxo-1H-pyrimidin-2-yl]azanide;yttrium
CID 135992020
4-(aminomethoxy)-1H-pyrimidin-6-one
CID 174857239
2-methoxy-6-oxo-1H-pyrimidin-4-olate
CID 86306347
N-(6-oxo-1,6-dihydropyrimidin-4-yl)acetamide
CID 135502010
N-(6-Oxo-1,6-dihydropyrimidin-4-yl)formamide
CID 136209108

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide?
The IUPAC name of N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide (CID 135968250) is N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide.
What is the SMILES notation for N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide?
The canonical SMILES for N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide is COc1nc(NC=O)cc(=O)[nH]1.
What is the InChIKey of N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide?
The InChIKey is LFIUZWHAVGTIQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O3/c1-12-6-8-4(7-3-10)2-5(11)9-6/h2-3H,1H3,(H2,7,8,9,10,11).
What are the key properties of N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide?
N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide has a molecular weight of 169.14 g/mol, XLogP of -0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-6-oxo-1H-pyrimidin-4-yl)formamide is sourced from PubChem (CID 135968250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).