1-(6-chloropyridazin-3-yl)oxypropan-2-amine

C7H10ClN3O — CID 23313311

IUPAC1-(6-chloropyridazin-3-yl)oxypropan-2-amine
SMILESCC(N)COc1ccc(Cl)nn1
InChIInChI=1S/C7H10ClN3O/c1-5(9)4-12-7-3-2-6(8)10-11-7/h2-3,5H,4,9H2,1H3
InChIKeySYGLWDLQSMXGKZ-UHFFFAOYSA-N
MW187.63 g/mol
LogP0.86
Rot. Bonds3

About 1-(6-chloropyridazin-3-yl)oxypropan-2-amine

1-(6-chloropyridazin-3-yl)oxypropan-2-amine (PubChem CID 23313311) has the molecular formula C7H10ClN3O and a molecular weight of 187.63 g/mol. Its IUPAC name is 1-(6-chloropyridazin-3-yl)oxypropan-2-amine.

Molecular Properties

Compound Name1-(6-chloropyridazin-3-yl)oxypropan-2-amine
PubChem CID23313311
Molecular FormulaC7H10ClN3O
Molecular Weight187.63 g/mol
Exact Mass187.05
IUPAC Name1-(6-chloropyridazin-3-yl)oxypropan-2-amine
SMILESCC(N)COc1ccc(Cl)nn1
InChIInChI=1S/C7H10ClN3O/c1-5(9)4-12-7-3-2-6(8)10-11-7/h2-3,5H,4,9H2,1H3
InChIKeySYGLWDLQSMXGKZ-UHFFFAOYSA-N
XLogP0.86
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.63
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-6-[2-(2-methylpropoxy)ethoxy]pyridazine
CID 106447482
1-(6-chloropyridazin-3-yl)oxy-3-(propan-2-ylamino)propan-2-ol
CID 10014778
N-[2-(6-chloropyridazin-3-yl)oxyethyl]-N-propan-2-ylpropan-2-amine
CID 115505459
3-(6-chloropyridazin-3-yl)oxypropan-1-amine
CID 23313459
3-chloro-6-(2-cyclopropylethoxy)pyridazine
CID 58075185
[6-(2-methylpropoxy)pyridazin-3-yl]methanamine
CID 62292495
(2S)-1-(2-chlorophenoxy)propan-2-amine
CID 42221597
1-[(3,5-dichloro-4-pyridinyl)oxy]propan-2-amine
CID 119082698
3-chloro-6-(2-propan-2-ylphenoxy)pyridazine
CID 54915404
3-chloro-6-(4-propoxyphenoxy)pyridazine
CID 60674904
1-(3-chlorophenoxy)propan-2-amine;hydrochloride
CID 86262438
3-chloro-6-[(3-methoxyphenyl)methoxy]pyridazine
CID 24702532

Frequently Asked Questions

What is the IUPAC name of 1-(6-chloropyridazin-3-yl)oxypropan-2-amine?
The IUPAC name of 1-(6-chloropyridazin-3-yl)oxypropan-2-amine (CID 23313311) is 1-(6-chloropyridazin-3-yl)oxypropan-2-amine.
What is the SMILES notation for 1-(6-chloropyridazin-3-yl)oxypropan-2-amine?
The canonical SMILES for 1-(6-chloropyridazin-3-yl)oxypropan-2-amine is CC(N)COc1ccc(Cl)nn1.
What is the InChIKey of 1-(6-chloropyridazin-3-yl)oxypropan-2-amine?
The InChIKey is SYGLWDLQSMXGKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3O/c1-5(9)4-12-7-3-2-6(8)10-11-7/h2-3,5H,4,9H2,1H3.
What are the key properties of 1-(6-chloropyridazin-3-yl)oxypropan-2-amine?
1-(6-chloropyridazin-3-yl)oxypropan-2-amine has a molecular weight of 187.63 g/mol, XLogP of 0.86, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloropyridazin-3-yl)oxypropan-2-amine is sourced from PubChem (CID 23313311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).