1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine

C14H20FNO — CID 117347443

IUPAC1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine
SMILESCOc1ccc(C(C)F)cc1C1(N)CCCC1
InChIInChI=1S/C14H20FNO/c1-10(15)11-5-6-13(17-2)12(9-11)14(16)7-3-4-8-14/h5-6,9-10H,3-4,7-8,16H2,1-2H3
InChIKeyBGDQTNDICXCVFA-UHFFFAOYSA-N
MW237.32 g/mol
LogP3.45
Rot. Bonds3

About 1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine

1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine (PubChem CID 117347443) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine
PubChem CID117347443
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine
SMILESCOc1ccc(C(C)F)cc1C1(N)CCCC1
InChIInChI=1S/C14H20FNO/c1-10(15)11-5-6-13(17-2)12(9-11)14(16)7-3-4-8-14/h5-6,9-10H,3-4,7-8,16H2,1-2H3
InChIKeyBGDQTNDICXCVFA-UHFFFAOYSA-N
XLogP3.45
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclobutan-1-amine
CID 117320262
1-[4-(1-fluoroethyl)-2,5-dimethoxyphenyl]cyclopentan-1-amine
CID 117421996
1-(2-methoxy-5-pentan-3-ylphenyl)cyclobutan-1-amine
CID 117371916
4-(2-methoxy-5-propan-2-ylphenyl)oxan-4-amine
CID 82297013
1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine
CID 43146587
1-[4-(1-fluoroethyl)phenyl]cyclopentan-1-amine
CID 117296684
1-(2,5-dimethoxy-4-propan-2-ylphenyl)cyclohexan-1-amine
CID 117444886
1-(5-cyclopentyl-2-methoxyphenyl)cyclohexan-1-amine
CID 117436622
1-(5-cyclohexyl-2-methoxyphenyl)cyclohexan-1-amine
CID 117464165
1-(4-fluoro-2-methoxy-5-propan-2-ylphenyl)cyclohexan-1-amine
CID 117418048
1-(5-fluoro-2-methoxyphenyl)-4,4-dimethylcyclohexan-1-amine
CID 82768870
1-(4-fluoro-2-methoxyphenyl)cyclopentan-1-amine
CID 82612097

Frequently Asked Questions

What is the IUPAC name of 1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine?
The IUPAC name of 1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine (CID 117347443) is 1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine.
What is the SMILES notation for 1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine?
The canonical SMILES for 1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine is COc1ccc(C(C)F)cc1C1(N)CCCC1.
What is the InChIKey of 1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine?
The InChIKey is BGDQTNDICXCVFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-10(15)11-5-6-13(17-2)12(9-11)14(16)7-3-4-8-14/h5-6,9-10H,3-4,7-8,16H2,1-2H3.
What are the key properties of 1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine?
1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine has a molecular weight of 237.32 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine is sourced from PubChem (CID 117347443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).