N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine

C15H20FNO2 — CID 66362950

IUPACN-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine
SMILESCOC1CCCC1NCC1Cc2cc(F)ccc2O1
InChIInChI=1S/C15H20FNO2/c1-18-15-4-2-3-13(15)17-9-12-8-10-7-11(16)5-6-14(10)19-12/h5-7,12-13,15,17H,2-4,8-9H2,1H3
InChIKeyGDEOTXKYYWKBNP-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.29
Rot. Bonds4

About N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine

N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine (PubChem CID 66362950) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine.

Molecular Properties

Compound NameN-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine
PubChem CID66362950
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC NameN-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine
SMILESCOC1CCCC1NCC1Cc2cc(F)ccc2O1
InChIInChI=1S/C15H20FNO2/c1-18-15-4-2-3-13(15)17-9-12-8-10-7-11(16)5-6-14(10)19-12/h5-7,12-13,15,17H,2-4,8-9H2,1H3
InChIKeyGDEOTXKYYWKBNP-UHFFFAOYSA-N
XLogP2.29
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylcycloheptan-1-amine
CID 66363148
N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]cycloheptanamine
CID 66365463
N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2,2,3,3-tetramethylcyclopropan-1-amine
CID 79359131
N-ethyl-2-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]cyclohexan-1-amine
CID 66364918
N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-3,4-dimethylcyclohexan-1-amine
CID 66364114
1-cyclopropyl-N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]ethanamine
CID 66364285
N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-3-methoxypropan-1-amine
CID 66365462
(1R)-1-cyclohexyl-N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]ethanamine
CID 81385411
N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-1-methoxy-2-methylpropan-2-amine
CID 113470358
N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-1-(2-methylcyclohexyl)methanamine
CID 66363715
N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]butan-2-amine
CID 66363891
2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methylamino]cyclohexan-1-ol
CID 66360581

Frequently Asked Questions

What is the IUPAC name of N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine?
The IUPAC name of N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine (CID 66362950) is N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine.
What is the SMILES notation for N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine?
The canonical SMILES for N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine is COC1CCCC1NCC1Cc2cc(F)ccc2O1.
What is the InChIKey of N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine?
The InChIKey is GDEOTXKYYWKBNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c1-18-15-4-2-3-13(15)17-9-12-8-10-7-11(16)5-6-14(10)19-12/h5-7,12-13,15,17H,2-4,8-9H2,1H3.
What are the key properties of N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine?
N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine has a molecular weight of 265.33 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methoxycyclopentan-1-amine is sourced from PubChem (CID 66362950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).