N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide

C15H20N2O3 — CID 66197601

IUPACN-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide
SMILESCCOC1CC(N)C1NC(=O)C1COc2ccccc21
InChIInChI=1S/C15H20N2O3/c1-2-19-13-7-11(16)14(13)17-15(18)10-8-20-12-6-4-3-5-9(10)12/h3-6,10-11,13-14H,2,7-8,16H2,1H3,(H,17,18)
InChIKeyFJSIQSAKOLKYCY-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.78
Rot. Bonds4

About N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide

N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide (PubChem CID 66197601) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide
PubChem CID66197601
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide
SMILESCCOC1CC(N)C1NC(=O)C1COc2ccccc21
InChIInChI=1S/C15H20N2O3/c1-2-19-13-7-11(16)14(13)17-15(18)10-8-20-12-6-4-3-5-9(10)12/h3-6,10-11,13-14H,2,7-8,16H2,1H3,(H,17,18)
InChIKeyFJSIQSAKOLKYCY-UHFFFAOYSA-N
XLogP0.78
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-N-[(1R,2R)-2-ethylcyclopropyl]-2,3-dihydro-1-benzofuran-3-carboxamide
CID 99808270
N-(2-amino-4-ethoxycyclobutyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66475604
N-(2-amino-4-ethoxycyclobutyl)-1,4-dioxane-2-carboxamide
CID 66195874
methyl (3S)-2,3-dihydro-1-benzofuran-3-carboxylate
CID 95340884
N-(2-amino-4-ethoxycyclobutyl)-5-methylthiophene-2-carboxamide
CID 66195121
butyl 2,3-dihydro-1-benzofuran-3-carboxylate
CID 78960804
(3R)-N-[(1R,2R)-2-carbamoylcyclopentyl]-2,3-dihydro-1-benzofuran-3-carboxamide
CID 124734322
N-[2-(hydroxymethyl)cyclopentyl]-2,3-dihydro-1-benzofuran-3-carboxamide
CID 103759058
2-[(2-amino-4-ethoxycyclobutyl)amino]benzamide
CID 66197262
N-(2-amino-4-ethoxycyclobutyl)-4-ethoxybenzamide
CID 66195694
bis(2,3-dihydro-1-benzofuran-3-yl)methanone
CID 174352835
N-(1-amino-2-cyclopropylpropan-2-yl)-2,3-dihydro-1-benzofuran-3-carboxamide
CID 81486749

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide?
The IUPAC name of N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide (CID 66197601) is N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide.
What is the SMILES notation for N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide?
The canonical SMILES for N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide is CCOC1CC(N)C1NC(=O)C1COc2ccccc21.
What is the InChIKey of N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide?
The InChIKey is FJSIQSAKOLKYCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-2-19-13-7-11(16)14(13)17-15(18)10-8-20-12-6-4-3-5-9(10)12/h3-6,10-11,13-14H,2,7-8,16H2,1H3,(H,17,18).
What are the key properties of N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide?
N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-ethoxycyclobutyl)-2,3-dihydro-1-benzofuran-3-carboxamide is sourced from PubChem (CID 66197601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).