1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine

C15H21NO2 — CID 114119430

IUPAC1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine
SMILESCOC1(CNCC2Cc3ccccc3O2)CCC1
InChIInChI=1S/C15H21NO2/c1-17-15(7-4-8-15)11-16-10-13-9-12-5-2-3-6-14(12)18-13/h2-3,5-6,13,16H,4,7-11H2,1H3
InChIKeyGEZDMPXJPRJTMN-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.15
Rot. Bonds5

About 1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine

1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine (PubChem CID 114119430) 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-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine
PubChem CID114119430
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine
SMILESCOC1(CNCC2Cc3ccccc3O2)CCC1
InChIInChI=1S/C15H21NO2/c1-17-15(7-4-8-15)11-16-10-13-9-12-5-2-3-6-14(12)18-13/h2-3,5-6,13,16H,4,7-11H2,1H3
InChIKeyGEZDMPXJPRJTMN-UHFFFAOYSA-N
XLogP2.15
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-propan-2-ylcyclopropyl)methyl]methanamine
CID 114113651
1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(4-methyloxan-4-yl)methyl]methanamine
CID 104585916
1-cyclohexyl-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)methanamine
CID 60752409
N-[[(2S)-2,3-dihydro-1-benzofuran-2-yl]methyl]propan-1-amine
CID 51885405
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2-iodoethanamine
CID 114505487
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2,3-dimethylbutan-1-amine
CID 66365130
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-3-methyl-2-propan-2-ylbutan-1-amine
CID 102905615
[1-(2,3-dihydro-1-benzofuran-2-ylmethoxy)cyclopentyl]methanamine
CID 66348950
N-benzyl-1-(2,3-dihydro-1-benzofuran-2-yl)methanamine
CID 19063201
1-(2,3-dihydro-1-benzofuran-2-ylmethylamino)butan-2-ol
CID 61004261
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)aniline
CID 54888631
N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-3-ethylpentan-3-amine
CID 66365713

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine?
The IUPAC name of 1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine (CID 114119430) is 1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine.
What is the SMILES notation for 1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine?
The canonical SMILES for 1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine is COC1(CNCC2Cc3ccccc3O2)CCC1.
What is the InChIKey of 1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine?
The InChIKey is GEZDMPXJPRJTMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-17-15(7-4-8-15)11-16-10-13-9-12-5-2-3-6-14(12)18-13/h2-3,5-6,13,16H,4,7-11H2,1H3.
What are the key properties of 1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine?
1-(2,3-dihydro-1-benzofuran-2-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine has a molecular weight of 247.34 g/mol, XLogP of 2.15, 5 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-yl)-N-[(1-methoxycyclobutyl)methyl]methanamine is sourced from PubChem (CID 114119430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).