[1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine

C15H21NO2 — CID 82622946

IUPAC[1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine
SMILESCOc1cc2c(cc1C1(CN)CCCC1)OCC2
InChIInChI=1S/C15H21NO2/c1-17-14-8-11-4-7-18-13(11)9-12(14)15(10-16)5-2-3-6-15/h8-9H,2-7,10,16H2,1H3
InChIKeyOJYBUCKXZGTVCM-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.40
Rot. Bonds3

About [1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine

[1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine (PubChem CID 82622946) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is [1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine
PubChem CID82622946
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name[1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine
SMILESCOc1cc2c(cc1C1(CN)CCCC1)OCC2
InChIInChI=1S/C15H21NO2/c1-17-14-8-11-4-7-18-13(11)9-12(14)15(10-16)5-2-3-6-15/h8-9H,2-7,10,16H2,1H3
InChIKeyOJYBUCKXZGTVCM-UHFFFAOYSA-N
XLogP2.40
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(6-methoxy-1,3-dihydro-2-benzofuran-5-yl)cyclohexyl]methanamine
CID 117408247
[1-(2,5-dimethoxy-4-methylphenyl)cyclopentyl]methanamine
CID 82499041
[1-(2,5-dimethoxy-4-methylsulfanylphenyl)cyclohexyl]methanamine
CID 117476236
[1-(4-chloro-2,5-dimethoxyphenyl)cyclohexyl]methanamine
CID 117456502
5-methoxy-2,3-dihydro-1-benzofuran-6-ol
CID 10953886
6-(1-isocyanatocyclopropyl)-5-methoxy-2,3-dihydro-1-benzofuran
CID 117333993
[1-(2,5-dimethoxy-4-propan-2-ylphenyl)cyclopentyl]methanamine
CID 117444927
[1-(2,5-dimethoxy-4-propan-2-yloxyphenyl)cyclopentyl]methanamine
CID 117473584
[1-(5-fluoro-2-methoxy-4-methylphenyl)cyclohexyl]methanamine
CID 117382102
[1-(2,3-dihydro-1-benzofuran-5-yl)cyclobutyl]methanamine
CID 82608645
[1-(5-chloro-4-fluoro-2-methoxyphenyl)cyclohexyl]methanamine
CID 117432368
[1-[7-(methoxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]cyclobutyl]methanamine
CID 117412717

Frequently Asked Questions

What is the IUPAC name of [1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine?
The IUPAC name of [1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine (CID 82622946) is [1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine.
What is the SMILES notation for [1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine?
The canonical SMILES for [1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine is COc1cc2c(cc1C1(CN)CCCC1)OCC2.
What is the InChIKey of [1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine?
The InChIKey is OJYBUCKXZGTVCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-17-14-8-11-4-7-18-13(11)9-12(14)15(10-16)5-2-3-6-15/h8-9H,2-7,10,16H2,1H3.
What are the key properties of [1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine?
[1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine has a molecular weight of 247.34 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)cyclopentyl]methanamine is sourced from PubChem (CID 82622946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).