2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone

C15H20FNO2 — CID 43795234

IUPAC2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone
SMILESCOc1ccc(F)cc1C(=O)CN(C)C1CCCC1
InChIInChI=1S/C15H20FNO2/c1-17(12-5-3-4-6-12)10-14(18)13-9-11(16)7-8-15(13)19-2/h7-9,12H,3-6,10H2,1-2H3
InChIKeyCRMJEZCTGDCVOQ-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.89
Rot. Bonds5

About 2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone

2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone (PubChem CID 43795234) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is 2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone.

Molecular Properties

Compound Name2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone
PubChem CID43795234
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC Name2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone
SMILESCOc1ccc(F)cc1C(=O)CN(C)C1CCCC1
InChIInChI=1S/C15H20FNO2/c1-17(12-5-3-4-6-12)10-14(18)13-9-11(16)7-8-15(13)19-2/h7-9,12H,3-6,10H2,1-2H3
InChIKeyCRMJEZCTGDCVOQ-UHFFFAOYSA-N
XLogP2.89
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclobutyl-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 103162387
1-(5-fluoro-2-methoxyphenyl)-2-[methyl(propyl)amino]ethanone
CID 43795594
2-(cyclopentylmethoxy)-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 66323732
1-(5-fluoro-2-methoxyphenyl)-2-[2-hydroxypropyl(methyl)amino]ethanone
CID 62334675
1-(5-fluoro-2-methoxyphenyl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]ethanone
CID 63207824
2-[benzyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 62051933
2-[ethyl(2-hydroxyethyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 62052022
1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone
CID 43228410
2-amino-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 79002350
2-[ethyl(3-hydroxypropyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 113468792
2-(2-ethylcyclohexyl)oxy-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 43798165
2-[cyclohexyl(methyl)amino]-1-(3,4,5-trimethoxyphenyl)ethanone
CID 2452744

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone?
The IUPAC name of 2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone (CID 43795234) is 2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone.
What is the SMILES notation for 2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone?
The canonical SMILES for 2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone is COc1ccc(F)cc1C(=O)CN(C)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone?
The InChIKey is CRMJEZCTGDCVOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c1-17(12-5-3-4-6-12)10-14(18)13-9-11(16)7-8-15(13)19-2/h7-9,12H,3-6,10H2,1-2H3.
What are the key properties of 2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone?
2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone has a molecular weight of 265.33 g/mol, XLogP of 2.89, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone is sourced from PubChem (CID 43795234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).