1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine

C15H19N3O — CID 43559559

IUPAC1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine
SMILESCCCc1nc(C2(N)CCCc3ccccc32)no1
InChIInChI=1S/C15H19N3O/c1-2-6-13-17-14(18-19-13)15(16)10-5-8-11-7-3-4-9-12(11)15/h3-4,7,9H,2,5-6,8,10,16H2,1H3
InChIKeyNBLWEIMUOYUFBZ-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.56
Rot. Bonds3

About 1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine

1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine (PubChem CID 43559559) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine.

Molecular Properties

Compound Name1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine
PubChem CID43559559
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine
SMILESCCCc1nc(C2(N)CCCc3ccccc32)no1
InChIInChI=1S/C15H19N3O/c1-2-6-13-17-14(18-19-13)15(16)10-5-8-11-7-3-4-9-12(11)15/h3-4,7,9H,2,5-6,8,10,16H2,1H3
InChIKeyNBLWEIMUOYUFBZ-UHFFFAOYSA-N
XLogP2.56
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine?
The IUPAC name of 1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine (CID 43559559) is 1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine.
What is the SMILES notation for 1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine?
The canonical SMILES for 1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine is CCCc1nc(C2(N)CCCc3ccccc32)no1.
What is the InChIKey of 1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine?
The InChIKey is NBLWEIMUOYUFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-2-6-13-17-14(18-19-13)15(16)10-5-8-11-7-3-4-9-12(11)15/h3-4,7,9H,2,5-6,8,10,16H2,1H3.
What are the key properties of 1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine?
1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine has a molecular weight of 257.34 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-propyl-1,2,4-oxadiazol-3-yl)-3,4-dihydro-2H-naphthalen-1-amine is sourced from PubChem (CID 43559559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).