N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide

C15H20N2O3 — CID 63287232

IUPACN-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide
SMILESCOCCN(CCCN)C(=O)c1cc2ccccc2o1
InChIInChI=1S/C15H20N2O3/c1-19-10-9-17(8-4-7-16)15(18)14-11-12-5-2-3-6-13(12)20-14/h2-3,5-6,11H,4,7-10,16H2,1H3
InChIKeyKDCQXSDDPVECSG-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.87
Rot. Bonds7

About N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide

N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide (PubChem CID 63287232) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide
PubChem CID63287232
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide
SMILESCOCCN(CCCN)C(=O)c1cc2ccccc2o1
InChIInChI=1S/C15H20N2O3/c1-19-10-9-17(8-4-7-16)15(18)14-11-12-5-2-3-6-13(12)20-14/h2-3,5-6,11H,4,7-10,16H2,1H3
InChIKeyKDCQXSDDPVECSG-UHFFFAOYSA-N
XLogP1.87
TPSA68.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-methyl-1-benzofuran-2-carboxamide
CID 115772526
N-(3-aminopropyl)-2-fluoro-N-(2-methoxyethyl)benzamide
CID 55173242
N-(2-methoxyethyl)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-benzofuran-2-carboxamide
CID 135722240
N-(3-aminopropyl)-N-(2-methoxyethyl)isoquinoline-1-carboxamide
CID 63287507
N-(2-hydroxy-3-methoxypropyl)-N-methyl-1-benzofuran-2-carboxamide
CID 54993279
5-amino-N-(2-cyanoethyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide
CID 63284227
N-(2-bromoethyl)-N-ethyl-1-benzofuran-2-carboxamide
CID 80660638
4-[1-benzofuran-2-carbonyl(methyl)amino]butanoic acid
CID 43235400
N-(3-aminopropyl)-N-(2-methoxyethyl)-2-(4-methoxyphenyl)acetamide
CID 63287501
N-(3-aminopropyl)-N-(2-methoxyethyl)-2,3-dimethylbenzamide
CID 55173243
N-benzyl-N-ethyl-1-benzofuran-2-carboxamide
CID 110698803
N-(3-aminopropyl)-N-(2-methoxyethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 63287503

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide (CID 63287232) is N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide is COCCN(CCCN)C(=O)c1cc2ccccc2o1.
What is the InChIKey of N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide?
The InChIKey is KDCQXSDDPVECSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-19-10-9-17(8-4-7-16)15(18)14-11-12-5-2-3-6-13(12)20-14/h2-3,5-6,11H,4,7-10,16H2,1H3.
What are the key properties of N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide?
N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.87, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 63287232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).