[1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine

C15H21NO2 — CID 66348950

IUPAC[1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine
SMILESNCC1(OCC2Cc3ccccc3O2)CCCC1
InChIInChI=1S/C15H21NO2/c16-11-15(7-3-4-8-15)17-10-13-9-12-5-1-2-6-14(12)18-13/h1-2,5-6,13H,3-4,7-11,16H2
InChIKeyXINJDQAVYRUGGK-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.28
Rot. Bonds4

About [1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine

[1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine (PubChem CID 66348950) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is [1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine
PubChem CID66348950
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name[1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine
SMILESNCC1(OCC2Cc3ccccc3O2)CCCC1
InChIInChI=1S/C15H21NO2/c16-11-15(7-3-4-8-15)17-10-13-9-12-5-1-2-6-14(12)18-13/h1-2,5-6,13H,3-4,7-11,16H2
InChIKeyXINJDQAVYRUGGK-UHFFFAOYSA-N
XLogP2.28
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)-4-methylcyclohexyl]methanamine
CID 66348952
1-(2,3-dihydro-1-benzofuran-2-ylmethyl)cyclooctan-1-amine
CID 80603246
[3-methyl-1-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]cyclohexyl]methanamine
CID 66360165
1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine
CID 114119430
[1-(3,4-dihydro-2H-chromen-4-ylmethoxy)cyclohexyl]methanamine
CID 104768023
[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl methanesulfonate
CID 11195526
2,3-dihydro-1-benzofuran-2-ylmethyl 3,5-diaminobenzoate
CID 66365761
(1-phenylmethoxycyclopentyl)methanamine
CID 62107893
3-(2,3-dihydro-1-benzofuran-2-yl)prop-1-en-1-amine
CID 70406652
1-amino-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)cyclobutane-1-carboxamide
CID 81172657
(2R)-2-(2,3-dihydro-1-benzofuran-2-ylmethoxy)propanoic acid
CID 104875432
2-(methylsulfanylmethyl)-2,3-dihydro-1-benzofuran
CID 12872573

Frequently Asked Questions

What is the IUPAC name of [1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine?
The IUPAC name of [1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine (CID 66348950) is [1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine.
What is the SMILES notation for [1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine?
The canonical SMILES for [1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine is NCC1(OCC2Cc3ccccc3O2)CCCC1.
What is the InChIKey of [1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine?
The InChIKey is XINJDQAVYRUGGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c16-11-15(7-3-4-8-15)17-10-13-9-12-5-1-2-6-14(12)18-13/h1-2,5-6,13H,3-4,7-11,16H2.
What are the key properties of [1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine?
[1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine has a molecular weight of 247.34 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine is sourced from PubChem (CID 66348950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).