2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol

C16H25NO2 — CID 60889044

IUPAC2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol
SMILESCCNC(C)c1cc(C)ccc1OC1CCCC1O
InChIInChI=1S/C16H25NO2/c1-4-17-12(3)13-10-11(2)8-9-15(13)19-16-7-5-6-14(16)18/h8-10,12,14,16-18H,4-7H2,1-3H3
InChIKeyWLMXGZMIXMIFKC-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.96
Rot. Bonds5

About 2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol

2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol (PubChem CID 60889044) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol
PubChem CID60889044
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol
SMILESCCNC(C)c1cc(C)ccc1OC1CCCC1O
InChIInChI=1S/C16H25NO2/c1-4-17-12(3)13-10-11(2)8-9-15(13)19-16-7-5-6-14(16)18/h8-10,12,14,16-18H,4-7H2,1-3H3
InChIKeyWLMXGZMIXMIFKC-UHFFFAOYSA-N
XLogP2.96
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-bromo-2-[1-(ethylamino)ethyl]phenoxy]cyclopentan-1-ol
CID 102947682
N-ethyl-1-[2-(4-ethylcyclohexyl)oxy-5-methylphenyl]ethanamine
CID 64747468
1-[2-(cyclopentylmethoxy)-5-methylphenyl]-N-ethylethanamine
CID 61344981
2-[3-[1-(ethylamino)ethyl]phenoxy]cyclopentan-1-ol
CID 60881566
trans-(1R,2R)-2-(2,5-dimethylphenoxy)cyclopentan-1-ol
CID 102735392
2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]cyclohexan-1-ol
CID 63651051
2-[2-[(1S)-1-aminoethyl]-5-methylphenoxy]cyclohexan-1-ol
CID 78947415
1-[2-(difluoromethoxy)-5-methylphenyl]-N-ethylethanamine
CID 43505197
2-[4-bromo-2-[1-(methylamino)ethyl]phenoxy]cyclohexan-1-ol
CID 62368559
1-(2-butoxy-5-methylphenyl)-N-ethylethanamine
CID 43505150
N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide
CID 62628087
N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine
CID 43505142

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol?
The IUPAC name of 2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol (CID 60889044) is 2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol.
What is the SMILES notation for 2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol?
The canonical SMILES for 2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol is CCNC(C)c1cc(C)ccc1OC1CCCC1O.
What is the InChIKey of 2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol?
The InChIKey is WLMXGZMIXMIFKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-4-17-12(3)13-10-11(2)8-9-15(13)19-16-7-5-6-14(16)18/h8-10,12,14,16-18H,4-7H2,1-3H3.
What are the key properties of 2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol?
2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol has a molecular weight of 263.38 g/mol, XLogP of 2.96, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]cyclopentan-1-ol is sourced from PubChem (CID 60889044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).