(1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene

C16H22O — CID 162910132

IUPAC(1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene
SMILESCOc1cc2c(cc1C)C(C(C)C)=CC[C@H]2C
InChIInChI=1S/C16H22O/c1-10(2)13-7-6-11(3)14-9-16(17-5)12(4)8-15(13)14/h7-11H,6H2,1-5H3/t11-/m1/s1
InChIKeyVMTKGTHHOWQTRO-LLVKDONJSA-N
MW230.35 g/mol
LogP4.55
Rot. Bonds2

About (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene

(1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene (PubChem CID 162910132) has the molecular formula C16H22O and a molecular weight of 230.35 g/mol. Its IUPAC name is (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene.

Molecular Properties

Compound Name(1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene
PubChem CID162910132
Molecular FormulaC16H22O
Molecular Weight230.35 g/mol
Exact Mass230.17
IUPAC Name(1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene
SMILESCOc1cc2c(cc1C)C(C(C)C)=CC[C@H]2C
InChIInChI=1S/C16H22O/c1-10(2)13-7-6-11(3)14-9-16(17-5)12(4)8-15(13)14/h7-11H,6H2,1-5H3/t11-/m1/s1
InChIKeyVMTKGTHHOWQTRO-LLVKDONJSA-N
XLogP4.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene?
The IUPAC name of (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene (CID 162910132) is (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene.
What is the SMILES notation for (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene?
The canonical SMILES for (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene is COc1cc2c(cc1C)C(C(C)C)=CC[C@H]2C.
What is the InChIKey of (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene?
The InChIKey is VMTKGTHHOWQTRO-LLVKDONJSA-N. The full InChI is InChI=1S/C16H22O/c1-10(2)13-7-6-11(3)14-9-16(17-5)12(4)8-15(13)14/h7-11H,6H2,1-5H3/t11-/m1/s1.
What are the key properties of (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene?
(1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene has a molecular weight of 230.35 g/mol, XLogP of 4.55, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-7-methoxy-1,6-dimethyl-4-propan-2-yl-1,2-dihydronaphthalene is sourced from PubChem (CID 162910132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).