6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine

C13H15N3O3 — CID 10106718

IUPAC6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine
SMILESCN(C)c1ccc(-c2ccc(C3OCCO3)o2)nn1
InChIInChI=1S/C13H15N3O3/c1-16(2)12-6-3-9(14-15-12)10-4-5-11(19-10)13-17-7-8-18-13/h3-6,13H,7-8H2,1-2H3
InChIKeyXLCKCAONEOHCOA-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.85
Rot. Bonds3

About 6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine

6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine (PubChem CID 10106718) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is 6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine.

Molecular Properties

Compound Name6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine
PubChem CID10106718
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC Name6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine
SMILESCN(C)c1ccc(-c2ccc(C3OCCO3)o2)nn1
InChIInChI=1S/C13H15N3O3/c1-16(2)12-6-3-9(14-15-12)10-4-5-11(19-10)13-17-7-8-18-13/h3-6,13H,7-8H2,1-2H3
InChIKeyXLCKCAONEOHCOA-UHFFFAOYSA-N
XLogP1.85
TPSA60.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine?
The IUPAC name of 6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine (CID 10106718) is 6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine.
What is the SMILES notation for 6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine?
The canonical SMILES for 6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine is CN(C)c1ccc(-c2ccc(C3OCCO3)o2)nn1.
What is the InChIKey of 6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine?
The InChIKey is XLCKCAONEOHCOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c1-16(2)12-6-3-9(14-15-12)10-4-5-11(19-10)13-17-7-8-18-13/h3-6,13H,7-8H2,1-2H3.
What are the key properties of 6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine?
6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine has a molecular weight of 261.28 g/mol, XLogP of 1.85, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(1,3-dioxolan-2-yl)furan-2-yl]-N,N-dimethylpyridazin-3-amine is sourced from PubChem (CID 10106718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).