5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine

C7H7Cl2N3 — CID 59299218

IUPAC5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine
SMILESCC1CN2C(Cl)=NC(Cl)=CC2=N1
InChIInChI=1S/C7H7Cl2N3/c1-4-3-12-6(10-4)2-5(8)11-7(12)9/h2,4H,3H2,1H3
InChIKeyMPURHILZRLIKAD-UHFFFAOYSA-N
MW204.06 g/mol
LogP1.78
Rot. Bonds

About 5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine

5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine (PubChem CID 59299218) has the molecular formula C7H7Cl2N3 and a molecular weight of 204.06 g/mol. Its IUPAC name is 5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine.

Molecular Properties

Compound Name5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine
PubChem CID59299218
Molecular FormulaC7H7Cl2N3
Molecular Weight204.06 g/mol
Exact Mass203.00
IUPAC Name5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine
SMILESCC1CN2C(Cl)=NC(Cl)=CC2=N1
InChIInChI=1S/C7H7Cl2N3/c1-4-3-12-6(10-4)2-5(8)11-7(12)9/h2,4H,3H2,1H3
InChIKeyMPURHILZRLIKAD-UHFFFAOYSA-N
XLogP1.78
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.06
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine?
The IUPAC name of 5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine (CID 59299218) is 5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine.
What is the SMILES notation for 5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine?
The canonical SMILES for 5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine is CC1CN2C(Cl)=NC(Cl)=CC2=N1.
What is the InChIKey of 5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine?
The InChIKey is MPURHILZRLIKAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7Cl2N3/c1-4-3-12-6(10-4)2-5(8)11-7(12)9/h2,4H,3H2,1H3.
What are the key properties of 5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine?
5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine has a molecular weight of 204.06 g/mol, XLogP of 1.78, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dichloro-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine is sourced from PubChem (CID 59299218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).