6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol

C14H19NO2 — CID 117338492

IUPAC6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol
SMILESNCC1(c2cc3c(cc2O)COC3)CCCC1
InChIInChI=1S/C14H19NO2/c15-9-14(3-1-2-4-14)12-5-10-7-17-8-11(10)6-13(12)16/h5-6,16H,1-4,7-9,15H2
InChIKeySVCPZLNZULOOET-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.19
Rot. Bonds2

About 6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol

6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol (PubChem CID 117338492) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol.

Molecular Properties

Compound Name6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol
PubChem CID117338492
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol
SMILESNCC1(c2cc3c(cc2O)COC3)CCCC1
InChIInChI=1S/C14H19NO2/c15-9-14(3-1-2-4-14)12-5-10-7-17-8-11(10)6-13(12)16/h5-6,16H,1-4,7-9,15H2
InChIKeySVCPZLNZULOOET-UHFFFAOYSA-N
XLogP2.19
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(6-methoxy-1,3-dihydro-2-benzofuran-5-yl)cyclohexyl]methanamine
CID 117408247
2-[1-(aminomethyl)cyclopentyl]-4,5-difluorophenol
CID 84791404
2-[1-(aminomethyl)cyclopentyl]-5-methylbenzene-1,4-diol
CID 117316086
7-[1-(aminomethyl)cyclobutyl]-2,3-dihydro-1,4-benzodioxin-6-ol
CID 117342304
2-[1-(aminomethyl)cyclopentyl]-4-fluorophenol
CID 82612123
2-[1-(aminomethyl)cyclopentyl]-4-chlorophenol
CID 131368937
6-[1-(aminomethyl)cyclopropyl]-1,3-benzodioxol-5-ol
CID 117295658
2-[1-(aminomethyl)cyclohexyl]-4-methylphenol
CID 82615959
2-[1-(aminomethyl)cyclopentyl]-5-chlorophenol
CID 131279076
2-[1-(aminomethyl)cyclopentyl]-5-chloro-4-methoxyphenol
CID 117392957
2-[1-(aminomethyl)cyclohexyl]-4-methoxy-5-methylphenol
CID 117377399
3-[1-(aminomethyl)cyclopentyl]-2-chloro-5-methylphenol
CID 117352123

Frequently Asked Questions

What is the IUPAC name of 6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol?
The IUPAC name of 6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol (CID 117338492) is 6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol.
What is the SMILES notation for 6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol?
The canonical SMILES for 6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol is NCC1(c2cc3c(cc2O)COC3)CCCC1.
What is the InChIKey of 6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol?
The InChIKey is SVCPZLNZULOOET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c15-9-14(3-1-2-4-14)12-5-10-7-17-8-11(10)6-13(12)16/h5-6,16H,1-4,7-9,15H2.
What are the key properties of 6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol?
6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol has a molecular weight of 233.31 g/mol, XLogP of 2.19, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(aminomethyl)cyclopentyl]-1,3-dihydro-2-benzofuran-5-ol is sourced from PubChem (CID 117338492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).