1,2-dihydronaphthalene;1,3-thiazole

C13H13NS — CID 68836302

IUPAC1,2-dihydronaphthalene;1,3-thiazole
SMILESC1=Cc2ccccc2CC1.c1cscn1
InChIInChI=1S/C10H10.C3H3NS/c1-2-6-10-8-4-3-7-9(10)5-1;1-2-5-3-4-1/h1-3,5-7H,4,8H2;1-3H
InChIKeySYNUKIJUURZJAE-UHFFFAOYSA-N
MW215.32 g/mol
LogP3.79
Rot. Bonds

About 1,2-dihydronaphthalene;1,3-thiazole

1,2-dihydronaphthalene;1,3-thiazole (PubChem CID 68836302) has the molecular formula C13H13NS and a molecular weight of 215.32 g/mol. Its IUPAC name is 1,2-dihydronaphthalene;1,3-thiazole.

Molecular Properties

Compound Name1,2-dihydronaphthalene;1,3-thiazole
PubChem CID68836302
Molecular FormulaC13H13NS
Molecular Weight215.32 g/mol
Exact Mass215.08
IUPAC Name1,2-dihydronaphthalene;1,3-thiazole
SMILESC1=Cc2ccccc2CC1.c1cscn1
InChIInChI=1S/C10H10.C3H3NS/c1-2-6-10-8-4-3-7-9(10)5-1;1-2-5-3-4-1/h1-3,5-7H,4,8H2;1-3H
InChIKeySYNUKIJUURZJAE-UHFFFAOYSA-N
XLogP3.79
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-dihydronaphthalene
CID 161389674
1,2-dihydronaphthalene
CID 9938
bis(1,2-dihydronaphthalene);bis(2,2-dimethylpropane);ethane
CID 159374922
1,2-dihydronaphthalene;phosphoryl trichloride
CID 91096847
7,8,9,10-tetrahydrobenzo[8]annulene
CID 54518791
(5E)-7,8,9,10,11,12-hexahydrobenzo[10]annulene
CID 134982097
10H-anthracen-9-one;1,3-thiazole
CID 70599678
1H-indene;pyrazine
CID 175286554
1,2-dihydronaphthalene;bis(2,2-dimethylpropane);1H-naphthalen-2-ylidenetungsten
CID 158118772
platinum(2+);bis(1,3-thiazole)
CID 4318153
6-azatricyclo[10.4.0.04,9]hexadeca-1(16),4(9),5,7,10,12,14-heptaene
CID 167682943
sodium;hydride;1,3-thiazole
CID 159645423

Frequently Asked Questions

What is the IUPAC name of 1,2-dihydronaphthalene;1,3-thiazole?
The IUPAC name of 1,2-dihydronaphthalene;1,3-thiazole (CID 68836302) is 1,2-dihydronaphthalene;1,3-thiazole.
What is the SMILES notation for 1,2-dihydronaphthalene;1,3-thiazole?
The canonical SMILES for 1,2-dihydronaphthalene;1,3-thiazole is C1=Cc2ccccc2CC1.c1cscn1.
What is the InChIKey of 1,2-dihydronaphthalene;1,3-thiazole?
The InChIKey is SYNUKIJUURZJAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10.C3H3NS/c1-2-6-10-8-4-3-7-9(10)5-1;1-2-5-3-4-1/h1-3,5-7H,4,8H2;1-3H.
What are the key properties of 1,2-dihydronaphthalene;1,3-thiazole?
1,2-dihydronaphthalene;1,3-thiazole has a molecular weight of 215.32 g/mol, XLogP of 3.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dihydronaphthalene;1,3-thiazole is sourced from PubChem (CID 68836302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).