6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride

C7H12ClN3O2 — CID 168824397

IUPAC6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride
SMILESCOCCn1nc(N)ccc1=O.Cl
InChIInChI=1S/C7H11N3O2.ClH/c1-12-5-4-10-7(11)3-2-6(8)9-10;/h2-3H,4-5H2,1H3,(H2,8,9);1H
InChIKeyONVPGDNXNDTQSC-UHFFFAOYSA-N
MW205.65 g/mol
LogP-0.11
Rot. Bonds3

About 6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride

6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride (PubChem CID 168824397) has the molecular formula C7H12ClN3O2 and a molecular weight of 205.65 g/mol. Its IUPAC name is 6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride.

Molecular Properties

Compound Name6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride
PubChem CID168824397
Molecular FormulaC7H12ClN3O2
Molecular Weight205.65 g/mol
Exact Mass205.06
IUPAC Name6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride
SMILESCOCCn1nc(N)ccc1=O.Cl
InChIInChI=1S/C7H11N3O2.ClH/c1-12-5-4-10-7(11)3-2-6(8)9-10;/h2-3H,4-5H2,1H3,(H2,8,9);1H
InChIKeyONVPGDNXNDTQSC-UHFFFAOYSA-N
XLogP-0.11
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.65
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride?
The IUPAC name of 6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride (CID 168824397) is 6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride.
What is the SMILES notation for 6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride?
The canonical SMILES for 6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride is COCCn1nc(N)ccc1=O.Cl.
What is the InChIKey of 6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride?
The InChIKey is ONVPGDNXNDTQSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2.ClH/c1-12-5-4-10-7(11)3-2-6(8)9-10;/h2-3H,4-5H2,1H3,(H2,8,9);1H.
What are the key properties of 6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride?
6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride has a molecular weight of 205.65 g/mol, XLogP of -0.11, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-(2-methoxyethyl)pyridazin-3-one;hydrochloride is sourced from PubChem (CID 168824397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).