N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide

C17H17NO3 — CID 46551065

IUPACN-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide
SMILESCc1ccc(C(=O)N(C)C(C)c2cc3ccccc3o2)o1
InChIInChI=1S/C17H17NO3/c1-11-8-9-15(20-11)17(19)18(3)12(2)16-10-13-6-4-5-7-14(13)21-16/h4-10,12H,1-3H3
InChIKeyAYAZDAWOWCYXJR-UHFFFAOYSA-N
MW283.33 g/mol
LogP4.17
Rot. Bonds3

About N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide

N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide (PubChem CID 46551065) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide
PubChem CID46551065
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC NameN-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide
SMILESCc1ccc(C(=O)N(C)C(C)c2cc3ccccc3o2)o1
InChIInChI=1S/C17H17NO3/c1-11-8-9-15(20-11)17(19)18(3)12(2)16-10-13-6-4-5-7-14(13)21-16/h4-10,12H,1-3H3
InChIKeyAYAZDAWOWCYXJR-UHFFFAOYSA-N
XLogP4.17
TPSA46.59 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1-benzofuran-2-yl)ethyl]-5-bromo-N-methylfuran-2-carboxamide
CID 46551193
N-[1-(1-benzofuran-2-yl)ethyl]-N,4-dimethylbenzamide
CID 46551169
N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyridine-4-carboxamide
CID 46551068
N-[1-(1-benzofuran-2-yl)ethyl]-2-(4-methoxyphenyl)-N-methylacetamide
CID 46551191
1-[1-(1-benzofuran-2-yl)ethyl]-3-[(4-methoxyphenyl)methyl]-1-methylurea
CID 134040576
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-N-methyl-1H-indole-2-carboxamide
CID 39976177
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-3,4-difluoro-N-methylbenzamide
CID 39976580
N-[1-(1-benzofuran-2-yl)ethyl]-4-ethoxy-N-methylbenzamide
CID 46550865
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-5-bromo-N-methylthiophene-2-carboxamide
CID 39976179
N-[1-(1-benzofuran-2-yl)ethyl]-N-methyl-4-(trifluoromethoxy)benzamide
CID 46550910
3-[1-(1-benzofuran-2-yl)ethyl-methylamino]-3-oxopropanoic acid
CID 55049773
(2S)-2-amino-N-[1-(1-benzofuran-2-yl)ethyl]-N,3-dimethylbutanamide
CID 61164290

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide?
The IUPAC name of N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide (CID 46551065) is N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide.
What is the SMILES notation for N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide?
The canonical SMILES for N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide is Cc1ccc(C(=O)N(C)C(C)c2cc3ccccc3o2)o1.
What is the InChIKey of N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide?
The InChIKey is AYAZDAWOWCYXJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO3/c1-11-8-9-15(20-11)17(19)18(3)12(2)16-10-13-6-4-5-7-14(13)21-16/h4-10,12H,1-3H3.
What are the key properties of N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide?
N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide has a molecular weight of 283.33 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide is sourced from PubChem (CID 46551065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).