N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide

C17H18N2O2 — CID 34441263

IUPACN-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide
SMILESCN(C)c1cccc(C(=O)Nc2ccc3c(c2)CCO3)c1
InChIInChI=1S/C17H18N2O2/c1-19(2)15-5-3-4-13(11-15)17(20)18-14-6-7-16-12(10-14)8-9-21-16/h3-7,10-11H,8-9H2,1-2H3,(H,18,20)
InChIKeyBMARAWVSVVRWLS-UHFFFAOYSA-N
MW282.34 g/mol
LogP2.94
Rot. Bonds3

About N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide

N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide (PubChem CID 34441263) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide
PubChem CID34441263
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide
SMILESCN(C)c1cccc(C(=O)Nc2ccc3c(c2)CCO3)c1
InChIInChI=1S/C17H18N2O2/c1-19(2)15-5-3-4-13(11-15)17(20)18-14-6-7-16-12(10-14)8-9-21-16/h3-7,10-11H,8-9H2,1-2H3,(H,18,20)
InChIKeyBMARAWVSVVRWLS-UHFFFAOYSA-N
XLogP2.94
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dihydro-1-benzofuran-5-yl)-4-(dimethylamino)benzamide
CID 38558648
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(dimethylamino)benzamide
CID 26070602
N-(3,4-dihydro-2H-chromen-6-yl)-4-(dimethylamino)benzamide
CID 110744167
methyl 3-(2,3-dihydro-1-benzofuran-5-carbonylamino)benzoate
CID 110693467
N'-[(E)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoyl]-3-(dimethylamino)benzohydrazide
CID 35824588
3-bromo-N-(2,3-dihydro-1-benzofuran-5-yl)-4-methylbenzamide
CID 79466753
3-(dimethylamino)-N-(4-methylphenyl)benzamide
CID 7899886
N-(3-acetylphenyl)-3-(dimethylamino)benzamide
CID 7922589
3-(dimethylamino)-N-(3-oxo-4H-1,4-benzoxazin-6-yl)benzamide
CID 51153492
N-(4-bromophenyl)-3-(dimethylamino)benzamide
CID 690521
3-bromo-N-(2,3-dihydro-1-benzofuran-5-yl)-5-methylbenzamide
CID 104852259
N-(4-carbamothioylphenyl)-3-(dimethylamino)benzamide
CID 43329185

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide?
The IUPAC name of N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide (CID 34441263) is N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide.
What is the SMILES notation for N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide?
The canonical SMILES for N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide is CN(C)c1cccc(C(=O)Nc2ccc3c(c2)CCO3)c1.
What is the InChIKey of N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide?
The InChIKey is BMARAWVSVVRWLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-19(2)15-5-3-4-13(11-15)17(20)18-14-6-7-16-12(10-14)8-9-21-16/h3-7,10-11H,8-9H2,1-2H3,(H,18,20).
What are the key properties of N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide?
N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide has a molecular weight of 282.34 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide is sourced from PubChem (CID 34441263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).