7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one

C6H4ClN3O — CID 21320102

IUPAC7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one
SMILESO=c1[nH]c(Cl)cc2nccn12
InChIInChI=1S/C6H4ClN3O/c7-4-3-5-8-1-2-10(5)6(11)9-4/h1-3H,(H,9,11)
InChIKeyMORDDYJPVSRHAG-UHFFFAOYSA-N
MW169.57 g/mol
LogP0.68
Rot. Bonds

About 7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one

7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one (PubChem CID 21320102) has the molecular formula C6H4ClN3O and a molecular weight of 169.57 g/mol. Its IUPAC name is 7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one.

Molecular Properties

Compound Name7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one
PubChem CID21320102
Molecular FormulaC6H4ClN3O
Molecular Weight169.57 g/mol
Exact Mass169.00
IUPAC Name7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one
SMILESO=c1[nH]c(Cl)cc2nccn12
InChIInChI=1S/C6H4ClN3O/c7-4-3-5-8-1-2-10(5)6(11)9-4/h1-3H,(H,9,11)
InChIKeyMORDDYJPVSRHAG-UHFFFAOYSA-N
XLogP0.68
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.57
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one 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 7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one?
The IUPAC name of 7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one (CID 21320102) is 7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one.
What is the SMILES notation for 7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one?
The canonical SMILES for 7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one is O=c1[nH]c(Cl)cc2nccn12.
What is the InChIKey of 7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one?
The InChIKey is MORDDYJPVSRHAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4ClN3O/c7-4-3-5-8-1-2-10(5)6(11)9-4/h1-3H,(H,9,11).
What are the key properties of 7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one?
7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one has a molecular weight of 169.57 g/mol, XLogP of 0.68, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-6H-imidazo[1,2-c]pyrimidin-5-one is sourced from PubChem (CID 21320102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).