2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene

C26H38O — CID 123570731

IUPAC2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene
SMILESCC(C)C(C)(C)c1ccc2cc(OC3CCC(C(C)(C)C)CC3)ccc2c1
InChIInChI=1S/C26H38O/c1-18(2)26(6,7)22-10-8-20-17-24(13-9-19(20)16-22)27-23-14-11-21(12-15-23)25(3,4)5/h8-10,13,16-18,21,23H,11-12,14-15H2,1-7H3
InChIKeyOEXNUXRHUNANNP-UHFFFAOYSA-N
MW366.59 g/mol
LogP7.76
Rot. Bonds4

About 2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene

2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene (PubChem CID 123570731) has the molecular formula C26H38O and a molecular weight of 366.59 g/mol. Its IUPAC name is 2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene.

Molecular Properties

Compound Name2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene
PubChem CID123570731
Molecular FormulaC26H38O
Molecular Weight366.59 g/mol
Exact Mass366.29
IUPAC Name2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene
SMILESCC(C)C(C)(C)c1ccc2cc(OC3CCC(C(C)(C)C)CC3)ccc2c1
InChIInChI=1S/C26H38O/c1-18(2)26(6,7)22-10-8-20-17-24(13-9-19(20)16-22)27-23-14-11-21(12-15-23)25(3,4)5/h8-10,13,16-18,21,23H,11-12,14-15H2,1-7H3
InChIKeyOEXNUXRHUNANNP-UHFFFAOYSA-N
XLogP7.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.59
LogP ≤ 57.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[2-[6-(4-tert-butylcyclohexyl)oxynaphthalen-2-yl]propan-2-ylamino]propanoic acid
CID 70496663
2-[[6-(4-tert-butylcyclohexyl)oxynaphthalen-2-yl]-methylamino]propanoic acid
CID 51002209
(2R)-2-amino-2-[6-(4-propan-2-ylcyclohexyl)oxynaphthalen-2-yl]propan-1-ol
CID 46196262
2-[6-(4-tert-butylcyclohexyl)oxyquinolin-2-yl]propan-2-amine
CID 70497244
2-tert-butyl-6-cyclopropyloxynaphthalene;6-tert-butyl-2-cyclopropyloxyquinoline
CID 159751617
3-[[6-(4-tert-butylcyclohexyl)oxynaphthalen-2-yl]-methylamino]butanoic acid
CID 51002210
2-[[6-(4-tert-butylcyclohexyl)oxynaphthalen-2-yl]methylamino]acetonitrile
CID 86668419
(2R)-2-amino-2-[6-(4-butan-2-ylcyclohexyl)oxynaphthalen-2-yl]propan-1-ol
CID 46196243
3-[[6-(4-tert-butylcyclohexyl)oxynaphthalen-2-yl]-methylamino]cyclobutane-1-carboxylic acid
CID 70498486
1-[6-[4-(trifluoromethyl)cyclohexyl]oxynaphthalen-2-yl]ethanethiol
CID 150872718
3-[[6-(4-tert-butylcyclohexyl)oxynaphthalen-2-yl]methylamino]hexanoic acid
CID 66926337
2-(4-propan-2-ylcyclohexyl)oxynaphthalene
CID 141348691

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene?
The IUPAC name of 2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene (CID 123570731) is 2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene.
What is the SMILES notation for 2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene?
The canonical SMILES for 2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene is CC(C)C(C)(C)c1ccc2cc(OC3CCC(C(C)(C)C)CC3)ccc2c1.
What is the InChIKey of 2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene?
The InChIKey is OEXNUXRHUNANNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H38O/c1-18(2)26(6,7)22-10-8-20-17-24(13-9-19(20)16-22)27-23-14-11-21(12-15-23)25(3,4)5/h8-10,13,16-18,21,23H,11-12,14-15H2,1-7H3.
What are the key properties of 2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene?
2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene has a molecular weight of 366.59 g/mol, XLogP of 7.76, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylcyclohexyl)oxy-6-(2,3-dimethylbutan-2-yl)naphthalene is sourced from PubChem (CID 123570731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).