N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide

C10H16N4O3 — CID 66758971

IUPACN-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide
SMILESCCCCCC(=O)Nc1c(O)nc(N)[nH]c1=O
InChIInChI=1S/C10H16N4O3/c1-2-3-4-5-6(15)12-7-8(16)13-10(11)14-9(7)17/h2-5H2,1H3,(H,12,15)(H4,11,13,14,16,17)
InChIKeyLKGKWHBHCMQTQV-UHFFFAOYSA-N
MW240.26 g/mol
LogP0.58
Rot. Bonds5

About N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide

N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide (PubChem CID 66758971) has the molecular formula C10H16N4O3 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide.

Molecular Properties

Compound NameN-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide
PubChem CID66758971
Molecular FormulaC10H16N4O3
Molecular Weight240.26 g/mol
Exact Mass240.12
IUPAC NameN-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide
SMILESCCCCCC(=O)Nc1c(O)nc(N)[nH]c1=O
InChIInChI=1S/C10H16N4O3/c1-2-3-4-5-6(15)12-7-8(16)13-10(11)14-9(7)17/h2-5H2,1H3,(H,12,15)(H4,11,13,14,16,17)
InChIKeyLKGKWHBHCMQTQV-UHFFFAOYSA-N
XLogP0.58
TPSA121.10 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 50.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)cyclohexanecarboxamide
CID 66758088
2-amino-4-hydroxy-5-(pentylamino)-1H-pyrimidin-6-one
CID 66758684
N-[6-oxo-4-(pentanoylamino)-1H-pyrimidin-5-yl]pentanamide
CID 135802458
N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)propanamide
CID 66759217

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide?
The IUPAC name of N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide (CID 66758971) is N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide.
What is the SMILES notation for N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide?
The canonical SMILES for N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide is CCCCCC(=O)Nc1c(O)nc(N)[nH]c1=O.
What is the InChIKey of N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide?
The InChIKey is LKGKWHBHCMQTQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3/c1-2-3-4-5-6(15)12-7-8(16)13-10(11)14-9(7)17/h2-5H2,1H3,(H,12,15)(H4,11,13,14,16,17).
What are the key properties of N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide?
N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide has a molecular weight of 240.26 g/mol, XLogP of 0.58, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)hexanamide is sourced from PubChem (CID 66758971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).