N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide

C5H6N4O2 — CID 135449818

IUPACN-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide
SMILESNc1nc[nH]c(=O)c1NC=O
InChIInChI=1S/C5H6N4O2/c6-4-3(9-2-10)5(11)8-1-7-4/h1-2H,(H,9,10)(H3,6,7,8,11)
InChIKeyISOPYSSRZGKNQL-UHFFFAOYSA-N
MW154.13 g/mol
LogP-1.08
Rot. Bonds2

About N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide

N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide (PubChem CID 135449818) has the molecular formula C5H6N4O2 and a molecular weight of 154.13 g/mol. Its IUPAC name is N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide.

Molecular Properties

Compound NameN-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide
PubChem CID135449818
Molecular FormulaC5H6N4O2
Molecular Weight154.13 g/mol
Exact Mass154.05
IUPAC NameN-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide
SMILESNc1nc[nH]c(=O)c1NC=O
InChIInChI=1S/C5H6N4O2/c6-4-3(9-2-10)5(11)8-1-7-4/h1-2H,(H,9,10)(H3,6,7,8,11)
InChIKeyISOPYSSRZGKNQL-UHFFFAOYSA-N
XLogP-1.08
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.13
LogP ≤ 5-1.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide?
The IUPAC name of N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide (CID 135449818) is N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide.
What is the SMILES notation for N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide?
The canonical SMILES for N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide is Nc1nc[nH]c(=O)c1NC=O.
What is the InChIKey of N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide?
The InChIKey is ISOPYSSRZGKNQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N4O2/c6-4-3(9-2-10)5(11)8-1-7-4/h1-2H,(H,9,10)(H3,6,7,8,11).
What are the key properties of N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide?
N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide has a molecular weight of 154.13 g/mol, XLogP of -1.08, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-6-oxo-1H-pyrimidin-5-yl)formamide is sourced from PubChem (CID 135449818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).