6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine

C15H15N5O — CID 53013577

IUPAC6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine
SMILESCCCNc1ccc(-c2nc(-c3ccccc3)no2)nn1
InChIInChI=1S/C15H15N5O/c1-2-10-16-13-9-8-12(18-19-13)15-17-14(20-21-15)11-6-4-3-5-7-11/h3-9H,2,10H2,1H3,(H,16,19)
InChIKeyAHADTUDISZQADA-UHFFFAOYSA-N
MW281.32 g/mol
LogP3.02
Rot. Bonds5

About 6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine

6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine (PubChem CID 53013577) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is 6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine.

Molecular Properties

Compound Name6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine
PubChem CID53013577
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC Name6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine
SMILESCCCNc1ccc(-c2nc(-c3ccccc3)no2)nn1
InChIInChI=1S/C15H15N5O/c1-2-10-16-13-9-8-12(18-19-13)15-17-14(20-21-15)11-6-4-3-5-7-11/h3-9H,2,10H2,1H3,(H,16,19)
InChIKeyAHADTUDISZQADA-UHFFFAOYSA-N
XLogP3.02
TPSA76.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(4-Tert-butylphenyl)-1-[6-[3-(hydroxymethyl)-1,2,4-oxadiazol-5-yl]pyridazin-3-yl]piperidine-4-carbonitrile
CID 124192338
[5-[6-[4-Phenyl-4-(trifluoromethyl)piperidin-1-yl]pyridazin-3-yl]-1,2,4-oxadiazol-3-yl]methanol
CID 124192489
3-ethyl-5-[5-(1-ethyl-5-phenylpyrazol-3-yl)-1,2,4-oxadiazol-3-yl]-6-methyl-1H-pyridin-2-one
CID 136147416
1-[6-[3-(Hydroxymethyl)-1,2,4-oxadiazol-5-yl]pyridazin-3-yl]-4-phenylpiperidine-4-carbonitrile
CID 137646974
1-[6-[3-(Hydroxymethyl)-1,2,4-oxadiazol-5-yl]pyridazin-3-yl]-4-phenylpiperidin-4-ol
CID 137639011
[5-[6-(4-Amino-4-phenylpiperidin-1-yl)pyridazin-3-yl]-1,2,4-oxadiazol-3-yl]methanol
CID 137654711
4-(3-Cyclopropyl-1,2,4-oxadiazol-5-YL)-N-[(2-fluorophenyl)methyl]phthalazin-1-amine
CID 53182428
4-(3-Cyclopropyl-1,2,4-oxadiazol-5-YL)-N-[(2,5-difluorophenyl)methyl]phthalazin-1-amine
CID 53182463
N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1-pyridazin-3-ylpiperidin-3-amine
CID 53612923
N-Cyclohexyl-4-(3-cyclopropyl-1,2,4-oxadiazol-5-YL)phthalazin-1-amine
CID 53182411
N-Cyclopentyl-4-(3-cyclopropyl-1,2,4-oxadiazol-5-YL)phthalazin-1-amine
CID 53182426
2-[3-(1-Benzoylpiperidin-3-YL)-1,2,4-oxadiazol-5-YL]-6-methyl-4H,5H-pyrazolo[1,5-A]pyrazin-4-one
CID 91891339

Frequently Asked Questions

What is the IUPAC name of 6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine?
The IUPAC name of 6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine (CID 53013577) is 6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine.
What is the SMILES notation for 6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine?
The canonical SMILES for 6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine is CCCNc1ccc(-c2nc(-c3ccccc3)no2)nn1.
What is the InChIKey of 6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine?
The InChIKey is AHADTUDISZQADA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-2-10-16-13-9-8-12(18-19-13)15-17-14(20-21-15)11-6-4-3-5-7-11/h3-9H,2,10H2,1H3,(H,16,19).
What are the key properties of 6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine?
6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine has a molecular weight of 281.32 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylpyridazin-3-amine is sourced from PubChem (CID 53013577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).