1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene

C15H22 — CID 168800688

IUPAC1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene
SMILESCc1ccc2c(c1)CC(C(C)C)CC2C
InChIInChI=1S/C15H22/c1-10(2)13-8-12(4)15-6-5-11(3)7-14(15)9-13/h5-7,10,12-13H,8-9H2,1-4H3
InChIKeyOAPHDVDTNPAXDO-UHFFFAOYSA-N
MW202.34 g/mol
LogP4.32
Rot. Bonds1

About 1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene

1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene (PubChem CID 168800688) has the molecular formula C15H22 and a molecular weight of 202.34 g/mol. Its IUPAC name is 1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene
PubChem CID168800688
Molecular FormulaC15H22
Molecular Weight202.34 g/mol
Exact Mass202.17
IUPAC Name1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene
SMILESCc1ccc2c(c1)CC(C(C)C)CC2C
InChIInChI=1S/C15H22/c1-10(2)13-8-12(4)15-6-5-11(3)7-14(15)9-13/h5-7,10,12-13H,8-9H2,1-4H3
InChIKeyOAPHDVDTNPAXDO-UHFFFAOYSA-N
XLogP4.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene (CID 168800688) is 1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene is Cc1ccc2c(c1)CC(C(C)C)CC2C.
What is the InChIKey of 1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene?
The InChIKey is OAPHDVDTNPAXDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22/c1-10(2)13-8-12(4)15-6-5-11(3)7-14(15)9-13/h5-7,10,12-13H,8-9H2,1-4H3.
What are the key properties of 1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene?
1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene has a molecular weight of 202.34 g/mol, XLogP of 4.32, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-3-propan-2-yl-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 168800688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).