(2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol

C19H24O2 — CID 107181495

IUPAC(2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol
SMILESCOc1ccc(C(O)C2CCCC2(C)C)c2ccccc12
InChIInChI=1S/C19H24O2/c1-19(2)12-6-9-16(19)18(20)15-10-11-17(21-3)14-8-5-4-7-13(14)15/h4-5,7-8,10-11,16,18,20H,6,9,12H2,1-3H3
InChIKeyPFICQAJOOZKOQZ-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.71
Rot. Bonds3

About (2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol

(2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol (PubChem CID 107181495) has the molecular formula C19H24O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is (2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol.

Molecular Properties

Compound Name(2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol
PubChem CID107181495
Molecular FormulaC19H24O2
Molecular Weight284.40 g/mol
Exact Mass284.18
IUPAC Name(2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol
SMILESCOc1ccc(C(O)C2CCCC2(C)C)c2ccccc12
InChIInChI=1S/C19H24O2/c1-19(2)12-6-9-16(19)18(20)15-10-11-17(21-3)14-8-5-4-7-13(14)15/h4-5,7-8,10-11,16,18,20H,6,9,12H2,1-3H3
InChIKeyPFICQAJOOZKOQZ-UHFFFAOYSA-N
XLogP4.71
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,2-dimethylcyclopropyl)-(4-methoxynaphthalen-1-yl)methanol
CID 107002440
(2,2-dimethylcyclopentyl)-(4-fluoronaphthalen-1-yl)methanol
CID 107181750
(2,2-dimethylcyclohexyl)-(2-methoxyphenyl)methanol
CID 107191971
(3-bromo-2,4-dimethoxyphenyl)-(2,2-dimethylcyclohexyl)methanol
CID 107181873
cyclopropyl-(4-methoxynaphthalen-1-yl)methanol
CID 61100695
(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methanol
CID 107181861
(2,2-dimethylcyclopropyl)-(4-methoxynaphthalen-1-yl)methanamine
CID 107000919
(2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol
CID 107192228
2-cyclobutyl-1-(4-methoxynaphthalen-1-yl)ethanol
CID 103165335
(1R)-1-(4-methoxynaphthalen-1-yl)ethanol
CID 82758527
(1S,2R)-2-amino-1-cyclohexyl-2-(4-methoxynaphthalen-1-yl)ethanol
CID 171266215
(1S,2R)-2-amino-1-cyclohexyl-2-(4-methoxynaphthalen-1-yl)ethanol;hydrochloride
CID 171266216

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol?
The IUPAC name of (2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol (CID 107181495) is (2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol.
What is the SMILES notation for (2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol?
The canonical SMILES for (2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol is COc1ccc(C(O)C2CCCC2(C)C)c2ccccc12.
What is the InChIKey of (2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol?
The InChIKey is PFICQAJOOZKOQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O2/c1-19(2)12-6-9-16(19)18(20)15-10-11-17(21-3)14-8-5-4-7-13(14)15/h4-5,7-8,10-11,16,18,20H,6,9,12H2,1-3H3.
What are the key properties of (2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol?
(2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol has a molecular weight of 284.40 g/mol, XLogP of 4.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol is sourced from PubChem (CID 107181495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).