6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine

C16H16N4O2 — CID 155956968

IUPAC6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESNC1CCCc2cc(-c3nc(Cc4ccno4)no3)ccc21
InChIInChI=1S/C16H16N4O2/c17-14-3-1-2-10-8-11(4-5-13(10)14)16-19-15(20-22-16)9-12-6-7-18-21-12/h4-8,14H,1-3,9,17H2
InChIKeyGOAHURLGTQPMSF-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.65
Rot. Bonds3

About 6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine

6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 155956968) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is 6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID155956968
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC Name6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESNC1CCCc2cc(-c3nc(Cc4ccno4)no3)ccc21
InChIInChI=1S/C16H16N4O2/c17-14-3-1-2-10-8-11(4-5-13(10)14)16-19-15(20-22-16)9-12-6-7-18-21-12/h4-8,14H,1-3,9,17H2
InChIKeyGOAHURLGTQPMSF-UHFFFAOYSA-N
XLogP2.65
TPSA90.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-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

Related Compounds

7-[3-[(7-methoxynaphthalen-1-yl)methyl]-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 167794474
7-[3-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 167792029
(1S)-6-[3-(7-bromoimidazo[1,2-a]pyridin-2-yl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 166430679
(1R)-6-[3-(7-bromoimidazo[1,2-a]pyridin-2-yl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 166430678
[4-[5-(5-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,4-oxadiazol-3-yl]phenyl]-(2-methylpyrrolidin-1-yl)methanone
CID 166337855
N-(3-chlorophenyl)-3-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]benzenesulfonamide
CID 166213096
6-N-methyl-1,2,3,4-tetrahydronaphthalene-1,6-diamine
CID 83816639
(1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine
CID 71416765
2-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1-benzothiophen-5-amine
CID 167771781
6-fluoro-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
CID 71757709
(1S)-6-ethenyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130914652
5-[3-(cyclobutylmethyl)-1,2,4-oxadiazol-5-yl]-2-iodoaniline
CID 112754175

Frequently Asked Questions

What is the IUPAC name of 6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine (CID 155956968) is 6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine is NC1CCCc2cc(-c3nc(Cc4ccno4)no3)ccc21.
What is the InChIKey of 6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is GOAHURLGTQPMSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2/c17-14-3-1-2-10-8-11(4-5-13(10)14)16-19-15(20-22-16)9-12-6-7-18-21-12/h4-8,14H,1-3,9,17H2.
What are the key properties of 6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine?
6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 296.33 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(1,2-oxazol-5-ylmethyl)-1,2,4-oxadiazol-5-yl]-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 155956968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).