bis(4-amino-1H-pyrimidin-2-one);dichlorocopper

C8H10Cl2CuN6O2 — CID 6389315

IUPACbis(4-amino-1H-pyrimidin-2-one);dichlorocopper
SMILESCl[Cu]Cl.Nc1cc[nH]c(=O)n1.Nc1cc[nH]c(=O)n1
InChIInChI=1S/2C4H5N3O.2ClH.Cu/c2*5-3-1-2-6-4(8)7-3;;;/h2*1-2H,(H3,5,6,7,8);2*1H;/q;;;;+2/p-2
InChIKeyYANOSERQOICLCQ-UHFFFAOYSA-L
MW356.66 g/mol
LogP0.08
Rot. Bonds

About bis(4-amino-1H-pyrimidin-2-one);dichlorocopper

bis(4-amino-1H-pyrimidin-2-one);dichlorocopper (PubChem CID 6389315) has the molecular formula C8H10Cl2CuN6O2 and a molecular weight of 356.66 g/mol. Its IUPAC name is bis(4-amino-1H-pyrimidin-2-one);dichlorocopper.

Molecular Properties

Compound Namebis(4-amino-1H-pyrimidin-2-one);dichlorocopper
PubChem CID6389315
Molecular FormulaC8H10Cl2CuN6O2
Molecular Weight356.66 g/mol
Exact Mass354.95
IUPAC Namebis(4-amino-1H-pyrimidin-2-one);dichlorocopper
SMILESCl[Cu]Cl.Nc1cc[nH]c(=O)n1.Nc1cc[nH]c(=O)n1
InChIInChI=1S/2C4H5N3O.2ClH.Cu/c2*5-3-1-2-6-4(8)7-3;;;/h2*1-2H,(H3,5,6,7,8);2*1H;/q;;;;+2/p-2
InChIKeyYANOSERQOICLCQ-UHFFFAOYSA-L
XLogP0.08
TPSA143.54 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.66
LogP ≤ 50.08
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze bis(4-amino-1H-pyrimidin-2-one);dichlorocopper with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(4-amino-1H-pyrimidin-2-one);dichlorocopper?
The IUPAC name of bis(4-amino-1H-pyrimidin-2-one);dichlorocopper (CID 6389315) is bis(4-amino-1H-pyrimidin-2-one);dichlorocopper.
What is the SMILES notation for bis(4-amino-1H-pyrimidin-2-one);dichlorocopper?
The canonical SMILES for bis(4-amino-1H-pyrimidin-2-one);dichlorocopper is Cl[Cu]Cl.Nc1cc[nH]c(=O)n1.Nc1cc[nH]c(=O)n1.
What is the InChIKey of bis(4-amino-1H-pyrimidin-2-one);dichlorocopper?
The InChIKey is YANOSERQOICLCQ-UHFFFAOYSA-L. The full InChI is InChI=1S/2C4H5N3O.2ClH.Cu/c2*5-3-1-2-6-4(8)7-3;;;/h2*1-2H,(H3,5,6,7,8);2*1H;/q;;;;+2/p-2.
What are the key properties of bis(4-amino-1H-pyrimidin-2-one);dichlorocopper?
bis(4-amino-1H-pyrimidin-2-one);dichlorocopper has a molecular weight of 356.66 g/mol, XLogP of 0.08, 0 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-amino-1H-pyrimidin-2-one);dichlorocopper is sourced from PubChem (CID 6389315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).