5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine

C16H25NO2 — CID 79857865

IUPAC5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine
SMILESCOCCc1ccc(OC2CCC(C)(C)C2N)cc1
InChIInChI=1S/C16H25NO2/c1-16(2)10-8-14(15(16)17)19-13-6-4-12(5-7-13)9-11-18-3/h4-7,14-15H,8-11,17H2,1-3H3
InChIKeyGSHLBPORKSMGQD-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.77
Rot. Bonds5

About 5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine

5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine (PubChem CID 79857865) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine
PubChem CID79857865
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine
SMILESCOCCc1ccc(OC2CCC(C)(C)C2N)cc1
InChIInChI=1S/C16H25NO2/c1-16(2)10-8-14(15(16)17)19-13-6-4-12(5-7-13)9-11-18-3/h4-7,14-15H,8-11,17H2,1-3H3
InChIKeyGSHLBPORKSMGQD-UHFFFAOYSA-N
XLogP2.77
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine
CID 79865783
[2-[4-(2-methoxyethyl)phenoxy]cyclohexyl]methanamine
CID 43294234
[2-[4-(2-methoxyethyl)phenoxy]cyclopentyl]methanamine
CID 43294230
6-(4-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-amine
CID 79836385
N-ethyl-2,2-dimethyl-5-(4-propylphenoxy)cyclopentan-1-amine
CID 79856403
1-(3-chlorocyclobutyl)oxy-4-(2-methoxyethyl)benzene
CID 66345556
6-(3,4-dimethylphenoxy)-2,2-dimethylcyclohexan-1-amine
CID 79837059
3-[4-(2-methoxyethyl)phenoxy]-N-methylcyclopentan-1-amine
CID 79642909
1-cyclohexyl-2-[4-(2-methoxyethyl)phenoxy]ethanamine
CID 104749060
5-(4-ethylphenoxy)-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79859799
5-[2-[4-(2-methoxyethyl)phenoxy]ethyl]-1,3-thiazolidine-2,4-dione
CID 22961925
1-cyclopentyl-2-[4-(2-methoxyethyl)phenoxy]ethanone
CID 104751852

Frequently Asked Questions

What is the IUPAC name of 5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine?
The IUPAC name of 5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine (CID 79857865) is 5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine.
What is the SMILES notation for 5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine?
The canonical SMILES for 5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine is COCCc1ccc(OC2CCC(C)(C)C2N)cc1.
What is the InChIKey of 5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine?
The InChIKey is GSHLBPORKSMGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-16(2)10-8-14(15(16)17)19-13-6-4-12(5-7-13)9-11-18-3/h4-7,14-15H,8-11,17H2,1-3H3.
What are the key properties of 5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine?
5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(2-methoxyethyl)phenoxy]-2,2-dimethylcyclopentan-1-amine is sourced from PubChem (CID 79857865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).