[2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol

C15H22FNO2 — CID 103786056

IUPAC[2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol
SMILESCOc1ccc(C(C)NC2CCCC2CO)cc1F
InChIInChI=1S/C15H22FNO2/c1-10(17-14-5-3-4-12(14)9-18)11-6-7-15(19-2)13(16)8-11/h6-8,10,12,14,17-18H,3-5,9H2,1-2H3
InChIKeyITZXFUPTDURDIL-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.65
Rot. Bonds5

About [2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol

[2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol (PubChem CID 103786056) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is [2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol
PubChem CID103786056
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name[2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol
SMILESCOc1ccc(C(C)NC2CCCC2CO)cc1F
InChIInChI=1S/C15H22FNO2/c1-10(17-14-5-3-4-12(14)9-18)11-6-7-15(19-2)13(16)8-11/h6-8,10,12,14,17-18H,3-5,9H2,1-2H3
InChIKeyITZXFUPTDURDIL-UHFFFAOYSA-N
XLogP2.65
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[[2-amino-1-(3-fluoro-4-methoxyphenyl)ethyl]amino]cyclohexyl]methanol
CID 106360364
4-[1-[[2-(hydroxymethyl)cyclohexyl]amino]ethyl]-2-methoxyphenol
CID 106359770
[2-[(3-fluoro-4-methoxyphenyl)methylamino]cyclopentyl]methanol
CID 103700320
[2-[1-(3-methoxyphenyl)ethylamino]cyclohexyl]methanol
CID 103729783
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-2-propylcyclopropan-1-amine
CID 103902769
[2-[1-(3,4-dimethoxyphenyl)propan-2-ylamino]cyclopentyl]methanol
CID 103786094
[2-[1-(4-ethylphenyl)ethylamino]cyclopentyl]methanol
CID 103786035
[2-[1-[3-(difluoromethoxy)phenyl]ethylamino]cyclopentyl]methanol
CID 103786076
4-ethyl-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 43225789
[2-[1-(4-methylsulfanylphenyl)ethylamino]cyclohexyl]methanol
CID 103717066
2-[[(1S)-1-(3-fluoro-4-methoxyphenyl)ethyl]amino]ethanol
CID 29039036
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-amine
CID 115892503

Frequently Asked Questions

What is the IUPAC name of [2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol?
The IUPAC name of [2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol (CID 103786056) is [2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol.
What is the SMILES notation for [2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol?
The canonical SMILES for [2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol is COc1ccc(C(C)NC2CCCC2CO)cc1F.
What is the InChIKey of [2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol?
The InChIKey is ITZXFUPTDURDIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c1-10(17-14-5-3-4-12(14)9-18)11-6-7-15(19-2)13(16)8-11/h6-8,10,12,14,17-18H,3-5,9H2,1-2H3.
What are the key properties of [2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol?
[2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol has a molecular weight of 267.34 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]cyclopentyl]methanol is sourced from PubChem (CID 103786056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).