1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine

C13H14FNO — CID 117312291

IUPAC1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine
SMILESNC1(c2cc3ccoc3cc2F)CCCC1
InChIInChI=1S/C13H14FNO/c14-11-8-12-9(3-6-16-12)7-10(11)13(15)4-1-2-5-13/h3,6-8H,1-2,4-5,15H2
InChIKeyJTUREYRQLAYHFE-UHFFFAOYSA-N
MW219.26 g/mol
LogP3.30
Rot. Bonds1

About 1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine

1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine (PubChem CID 117312291) has the molecular formula C13H14FNO and a molecular weight of 219.26 g/mol. Its IUPAC name is 1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine
PubChem CID117312291
Molecular FormulaC13H14FNO
Molecular Weight219.26 g/mol
Exact Mass219.11
IUPAC Name1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine
SMILESNC1(c2cc3ccoc3cc2F)CCCC1
InChIInChI=1S/C13H14FNO/c14-11-8-12-9(3-6-16-12)7-10(11)13(15)4-1-2-5-13/h3,6-8H,1-2,4-5,15H2
InChIKeyJTUREYRQLAYHFE-UHFFFAOYSA-N
XLogP3.30
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(6-fluoro-1-benzofuran-5-yl)cyclopropan-1-ol
CID 117282835
1-(6-fluoro-1-benzofuran-5-yl)cyclobutane-1-carboxylic acid
CID 117339986
1-(2,5-difluorophenyl)cyclopentan-1-amine
CID 62802401
1-(2,4-difluorophenyl)cyclohexan-1-amine
CID 62802198
1-(5-bromo-2,4-difluorophenyl)cyclopentan-1-amine
CID 84810883
1-(4-bromo-2-fluorophenyl)cyclopentan-1-amine
CID 83412154
1-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)cyclohexan-1-amine
CID 117371666
1-(2-fluoro-5-methylphenyl)cyclopentan-1-amine
CID 62788352
1-(2-chlorofuran-3-yl)cyclopentan-1-amine
CID 82655531
4-(1-aminocyclobutyl)-3-fluoroaniline
CID 83412510
1-(6-fluoro-2,3-dihydro-1-benzofuran-5-yl)cyclohexan-1-amine
CID 117342628
4-(1-aminocyclopropyl)-2,5-difluorophenol
CID 117280020

Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine?
The IUPAC name of 1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine (CID 117312291) is 1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine.
What is the SMILES notation for 1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine?
The canonical SMILES for 1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine is NC1(c2cc3ccoc3cc2F)CCCC1.
What is the InChIKey of 1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine?
The InChIKey is JTUREYRQLAYHFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FNO/c14-11-8-12-9(3-6-16-12)7-10(11)13(15)4-1-2-5-13/h3,6-8H,1-2,4-5,15H2.
What are the key properties of 1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine?
1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine has a molecular weight of 219.26 g/mol, XLogP of 3.30, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-1-benzofuran-5-yl)cyclopentan-1-amine is sourced from PubChem (CID 117312291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).