3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole

C14H15NO — CID 116868892

IUPAC3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole
SMILESCc1cc(-c2ccc3c(c2)CCCC3)on1
InChIInChI=1S/C14H15NO/c1-10-8-14(16-15-10)13-7-6-11-4-2-3-5-12(11)9-13/h6-9H,2-5H2,1H3
InChIKeyQSOAYXUTRHSFCZ-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.53
Rot. Bonds1

About 3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole

3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole (PubChem CID 116868892) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole.

Molecular Properties

Compound Name3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole
PubChem CID116868892
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole
SMILESCc1cc(-c2ccc3c(c2)CCCC3)on1
InChIInChI=1S/C14H15NO/c1-10-8-14(16-15-10)13-7-6-11-4-2-3-5-12(11)9-13/h6-9H,2-5H2,1H3
InChIKeyQSOAYXUTRHSFCZ-UHFFFAOYSA-N
XLogP3.53
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-methyl-1,2-oxazol-5-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzenesulfonamide
CID 20917438
2-(5,6,7,8-tetrahydronaphthalen-2-yl)furan
CID 90886598
1-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrazole
CID 116869099
5-(4-methylphenyl)-2,3-dihydro-1H-indene
CID 59217485
5-(4-butylphenyl)-3-methyl-1,2-oxazole
CID 169499000
5-(2,3-dihydro-1H-inden-5-yl)-3-methyl-1,2-oxazole-4-carbaldehyde
CID 82128256
3-(3-methyl-1,2-oxazol-5-yl)-5H-indazolo[2,3-a][3,1]benzoxazine
CID 23640909
2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzenesulfonamide
CID 20935126
3-methyl-5-(4-methylsulfonylphenyl)-1,2-oxazole
CID 116868966
N-cyclohexyl-N,2-dimethyl-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamide
CID 20934956
1-[4-[4-(3-methyl-1,2-oxazol-5-yl)phenyl]phenyl]cyclopropane-1-carboxylic acid
CID 163598398
4-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-5-ol
CID 116886008

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole?
The IUPAC name of 3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole (CID 116868892) is 3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole.
What is the SMILES notation for 3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole?
The canonical SMILES for 3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole is Cc1cc(-c2ccc3c(c2)CCCC3)on1.
What is the InChIKey of 3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole?
The InChIKey is QSOAYXUTRHSFCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-10-8-14(16-15-10)13-7-6-11-4-2-3-5-12(11)9-13/h6-9H,2-5H2,1H3.
What are the key properties of 3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole?
3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole has a molecular weight of 213.28 g/mol, XLogP of 3.53, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazole is sourced from PubChem (CID 116868892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).