3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine

C15H18N2O — CID 139770472

IUPAC3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine
SMILESCc1ccc2c(c1)C(c1nocc1N)CCC2C
InChIInChI=1S/C15H18N2O/c1-9-3-5-11-10(2)4-6-12(13(11)7-9)15-14(16)8-18-17-15/h3,5,7-8,10,12H,4,6,16H2,1-2H3
InChIKeyIRNWWZADCOAFCJ-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.59
Rot. Bonds1

About 3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine

3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine (PubChem CID 139770472) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine.

Molecular Properties

Compound Name3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine
PubChem CID139770472
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine
SMILESCc1ccc2c(c1)C(c1nocc1N)CCC2C
InChIInChI=1S/C15H18N2O/c1-9-3-5-11-10(2)4-6-12(13(11)7-9)15-14(16)8-18-17-15/h3,5,7-8,10,12H,4,6,16H2,1-2H3
InChIKeyIRNWWZADCOAFCJ-UHFFFAOYSA-N
XLogP3.59
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 ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1,6-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-1,2-oxazol-4-amine
CID 139770536
3-(3,6-dimethyl-2,3-dihydro-1H-inden-1-yl)-N,N-diethyl-1,2-oxazol-4-amine
CID 139770808
4,6-dimethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 155465000
(1S,4S)-1,6-dimethyl-4-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 6429077
2-[(1R,4S)-4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl]ethanol
CID 57386974
(1S,4S)-4-[(2S)-1-iodopropan-2-yl]-1,6-dimethyl-1,2,3,4-tetrahydronaphthalene
CID 24806500
3,5-dimethyl-2,3-dihydro-1H-inden-1-amine
CID 23008934
3-(1,5-dimethyl-2,3-dihydroinden-1-yl)-1,2-oxazol-4-amine
CID 139770443
3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-yl)-N,N-diethyl-1,2-oxazol-4-amine
CID 139770454
5-methyl-2-[(1S,2R)-2-methylcyclohexyl]aniline
CID 125449672
4-methyl-2-[(1R,2S)-2-methylcyclohexyl]aniline
CID 125449652
2-N-(4,6-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-6-ethyl-1,3,5-triazine-2,4-diamine
CID 67072807

Frequently Asked Questions

What is the IUPAC name of 3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine?
The IUPAC name of 3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine (CID 139770472) is 3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine.
What is the SMILES notation for 3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine?
The canonical SMILES for 3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine is Cc1ccc2c(c1)C(c1nocc1N)CCC2C.
What is the InChIKey of 3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine?
The InChIKey is IRNWWZADCOAFCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-9-3-5-11-10(2)4-6-12(13(11)7-9)15-14(16)8-18-17-15/h3,5,7-8,10,12H,4,6,16H2,1-2H3.
What are the key properties of 3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine?
3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine has a molecular weight of 242.32 g/mol, XLogP of 3.59, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazol-4-amine is sourced from PubChem (CID 139770472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).