8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene

C14H20 — CID 12778774

IUPAC8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
SMILESCc1cccc2c1C(C(C)C)CCC2
InChIInChI=1S/C14H20/c1-10(2)13-9-5-8-12-7-4-6-11(3)14(12)13/h4,6-7,10,13H,5,8-9H2,1-3H3
InChIKeyNZVDNKYGIDYYFW-UHFFFAOYSA-N
MW188.31 g/mol
LogP4.07
Rot. Bonds1

About 8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene

8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene (PubChem CID 12778774) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is 8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
PubChem CID12778774
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
SMILESCc1cccc2c1C(C(C)C)CCC2
InChIInChI=1S/C14H20/c1-10(2)13-9-5-8-12-7-4-6-11(3)14(12)13/h4,6-7,10,13H,5,8-9H2,1-3H3
InChIKeyNZVDNKYGIDYYFW-UHFFFAOYSA-N
XLogP4.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene (CID 12778774) is 8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene is Cc1cccc2c1C(C(C)C)CCC2.
What is the InChIKey of 8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene?
The InChIKey is NZVDNKYGIDYYFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20/c1-10(2)13-9-5-8-12-7-4-6-11(3)14(12)13/h4,6-7,10,13H,5,8-9H2,1-3H3.
What are the key properties of 8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene?
8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene has a molecular weight of 188.31 g/mol, XLogP of 4.07, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 12778774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).