N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine

C15H19NO — CID 113485353

IUPACN-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine
SMILESCCc1oc2ccccc2c1CNC1(C)CC1
InChIInChI=1S/C15H19NO/c1-3-13-12(10-16-15(2)8-9-15)11-6-4-5-7-14(11)17-13/h4-7,16H,3,8-10H2,1-2H3
InChIKeyWWKGGEYLXBXATA-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.64
Rot. Bonds4

About N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine

N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine (PubChem CID 113485353) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine.

Molecular Properties

Compound NameN-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine
PubChem CID113485353
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC NameN-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine
SMILESCCc1oc2ccccc2c1CNC1(C)CC1
InChIInChI=1S/C15H19NO/c1-3-13-12(10-16-15(2)8-9-15)11-6-4-5-7-14(11)17-13/h4-7,16H,3,8-10H2,1-2H3
InChIKeyWWKGGEYLXBXATA-UHFFFAOYSA-N
XLogP3.64
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine with MolForge

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Related Compounds

[1-[(2-ethyl-1-benzofuran-3-yl)methylamino]cyclopentyl]methanol
CID 62523800
N-[(2-ethyl-1-benzofuran-3-yl)methyl]-2,2-dimethylcyclopropan-1-amine
CID 61223383
N-[(2-chloro-1-benzofuran-3-yl)methyl]-1-methylcyclohexan-1-amine
CID 82760458
N-[(2-ethyl-1-benzofuran-3-yl)methyl]aniline
CID 43665972
(2R)-2-[(2-ethyl-1-benzofuran-3-yl)methylamino]propan-1-ol
CID 114986912
N-[(2-ethyl-1-benzofuran-3-yl)methyl]-3-methylbutan-2-amine
CID 43226118
N'-[(2-ethyl-1-benzofuran-3-yl)methyl]ethane-1,2-diamine
CID 60888739
N-[(2-ethyl-1-benzofuran-3-yl)methyl]cyclooctanamine
CID 43226088
N-[(2-ethyl-1-benzofuran-3-yl)methyl]pentan-1-amine
CID 43226064
4-ethyl-N-[(2-ethyl-1-benzofuran-3-yl)methyl]aniline
CID 43666008
3-[(2-ethyl-1-benzofuran-3-yl)methylamino]butan-1-ol
CID 78997742
1-cyclohexyl-N-[(2-ethyl-1-benzofuran-3-yl)methyl]methanamine
CID 43226082

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine?
The IUPAC name of N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine (CID 113485353) is N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine.
What is the SMILES notation for N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine?
The canonical SMILES for N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine is CCc1oc2ccccc2c1CNC1(C)CC1.
What is the InChIKey of N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine?
The InChIKey is WWKGGEYLXBXATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-3-13-12(10-16-15(2)8-9-15)11-6-4-5-7-14(11)17-13/h4-7,16H,3,8-10H2,1-2H3.
What are the key properties of N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine?
N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine has a molecular weight of 229.32 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethyl-1-benzofuran-3-yl)methyl]-1-methylcyclopropan-1-amine is sourced from PubChem (CID 113485353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).