3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine

C15H18N2O — CID 139770585

IUPAC3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine
SMILESCc1cccc2c1C(C)C(c1nocc1N)CC2
InChIInChI=1S/C15H18N2O/c1-9-4-3-5-11-6-7-12(10(2)14(9)11)15-13(16)8-18-17-15/h3-5,8,10,12H,6-7,16H2,1-2H3
InChIKeyZUYHIUYCEAHIAJ-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.40
Rot. Bonds1

About 3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine

3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine (PubChem CID 139770585) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine.

Molecular Properties

Compound Name3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine
PubChem CID139770585
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine
SMILESCc1cccc2c1C(C)C(c1nocc1N)CC2
InChIInChI=1S/C15H18N2O/c1-9-4-3-5-11-6-7-12(10(2)14(9)11)15-13(16)8-18-17-15/h3-5,8,10,12H,6-7,16H2,1-2H3
InChIKeyZUYHIUYCEAHIAJ-UHFFFAOYSA-N
XLogP3.40
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine?
The IUPAC name of 3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine (CID 139770585) is 3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine.
What is the SMILES notation for 3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine?
The canonical SMILES for 3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine is Cc1cccc2c1C(C)C(c1nocc1N)CC2.
What is the InChIKey of 3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine?
The InChIKey is ZUYHIUYCEAHIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-9-4-3-5-11-6-7-12(10(2)14(9)11)15-13(16)8-18-17-15/h3-5,8,10,12H,6-7,16H2,1-2H3.
What are the key properties of 3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine?
3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine has a molecular weight of 242.32 g/mol, XLogP of 3.40, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine is sourced from PubChem (CID 139770585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).