1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine

C15H23NO — CID 28917907

IUPAC1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine
SMILESCCc1cccc(OCCC2(N)CCCC2)c1
InChIInChI=1S/C15H23NO/c1-2-13-6-5-7-14(12-13)17-11-10-15(16)8-3-4-9-15/h5-7,12H,2-4,8-11,16H2,1H3
InChIKeyDUMHZQBDFZTNCM-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.29
Rot. Bonds5

About 1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine

1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine (PubChem CID 28917907) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine
PubChem CID28917907
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine
SMILESCCc1cccc(OCCC2(N)CCCC2)c1
InChIInChI=1S/C15H23NO/c1-2-13-6-5-7-14(12-13)17-11-10-15(16)8-3-4-9-15/h5-7,12H,2-4,8-11,16H2,1H3
InChIKeyDUMHZQBDFZTNCM-UHFFFAOYSA-N
XLogP3.29
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(3-bromophenoxy)ethyl]cyclohexan-1-amine
CID 28918025
1-[2-(3-bromophenoxy)ethyl]cyclooctan-1-amine
CID 80603583
1-[2-(3-methoxyphenyl)ethyl]cyclopentan-1-amine
CID 67382706
1-[[1-(bromomethyl)cyclopentyl]methoxy]-3-ethylbenzene
CID 65001286
1-ethyl-3-(3-phenoxypropoxy)benzene
CID 64765118
[4-[2-(3-ethylphenoxy)ethoxy]phenyl]methanamine
CID 43254277
1-(2-ethoxyethoxy)-3-ethylbenzene
CID 60642871
ethane;1-ethyl-3-(2-methoxyethoxy)benzene
CID 143725382
[4-[3-(3-ethylphenoxy)propoxy]phenyl]methanamine
CID 43254285
1-methyl-1-[2-(3-propoxyphenyl)ethyl]cyclooctane
CID 118144717
1-(4-bromobutoxy)-3-ethylbenzene
CID 43165198
1-(3-phenoxypropyl)cycloheptan-1-amine
CID 62937840

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine?
The IUPAC name of 1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine (CID 28917907) is 1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine?
The canonical SMILES for 1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine is CCc1cccc(OCCC2(N)CCCC2)c1.
What is the InChIKey of 1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine?
The InChIKey is DUMHZQBDFZTNCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-13-6-5-7-14(12-13)17-11-10-15(16)8-3-4-9-15/h5-7,12H,2-4,8-11,16H2,1H3.
What are the key properties of 1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine?
1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine has a molecular weight of 233.35 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-ethylphenoxy)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 28917907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).