2-[2-(cyclopentylamino)ethyl]pyridazin-3-one

C11H17N3O — CID 62849272

IUPAC2-[2-(cyclopentylamino)ethyl]pyridazin-3-one
SMILESO=c1cccnn1CCNC1CCCC1
InChIInChI=1S/C11H17N3O/c15-11-6-3-7-13-14(11)9-8-12-10-4-1-2-5-10/h3,6-7,10,12H,1-2,4-5,8-9H2
InChIKeyVGABNJHDIIZSID-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.78
Rot. Bonds4

About 2-[2-(cyclopentylamino)ethyl]pyridazin-3-one

2-[2-(cyclopentylamino)ethyl]pyridazin-3-one (PubChem CID 62849272) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-[2-(cyclopentylamino)ethyl]pyridazin-3-one.

Molecular Properties

Compound Name2-[2-(cyclopentylamino)ethyl]pyridazin-3-one
PubChem CID62849272
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-[2-(cyclopentylamino)ethyl]pyridazin-3-one
SMILESO=c1cccnn1CCNC1CCCC1
InChIInChI=1S/C11H17N3O/c15-11-6-3-7-13-14(11)9-8-12-10-4-1-2-5-10/h3,6-7,10,12H,1-2,4-5,8-9H2
InChIKeyVGABNJHDIIZSID-UHFFFAOYSA-N
XLogP0.78
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopentylamino)ethyl]pyridazin-3-one?
The IUPAC name of 2-[2-(cyclopentylamino)ethyl]pyridazin-3-one (CID 62849272) is 2-[2-(cyclopentylamino)ethyl]pyridazin-3-one.
What is the SMILES notation for 2-[2-(cyclopentylamino)ethyl]pyridazin-3-one?
The canonical SMILES for 2-[2-(cyclopentylamino)ethyl]pyridazin-3-one is O=c1cccnn1CCNC1CCCC1.
What is the InChIKey of 2-[2-(cyclopentylamino)ethyl]pyridazin-3-one?
The InChIKey is VGABNJHDIIZSID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c15-11-6-3-7-13-14(11)9-8-12-10-4-1-2-5-10/h3,6-7,10,12H,1-2,4-5,8-9H2.
What are the key properties of 2-[2-(cyclopentylamino)ethyl]pyridazin-3-one?
2-[2-(cyclopentylamino)ethyl]pyridazin-3-one has a molecular weight of 207.28 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopentylamino)ethyl]pyridazin-3-one is sourced from PubChem (CID 62849272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).