N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide

C15H18N2O3 — CID 43175539

IUPACN-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide
SMILESCc1cc(C(=O)Nc2cccc(OCCN)c2)c(C)o1
InChIInChI=1S/C15H18N2O3/c1-10-8-14(11(2)20-10)15(18)17-12-4-3-5-13(9-12)19-7-6-16/h3-5,8-9H,6-7,16H2,1-2H3,(H,17,18)
InChIKeyLNWDYTXSNSIWMS-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.49
Rot. Bonds5

About N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide

N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide (PubChem CID 43175539) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide
PubChem CID43175539
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC NameN-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide
SMILESCc1cc(C(=O)Nc2cccc(OCCN)c2)c(C)o1
InChIInChI=1S/C15H18N2O3/c1-10-8-14(11(2)20-10)15(18)17-12-4-3-5-13(9-12)19-7-6-16/h3-5,8-9H,6-7,16H2,1-2H3,(H,17,18)
InChIKeyLNWDYTXSNSIWMS-UHFFFAOYSA-N
XLogP2.49
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(2-aminoethoxy)phenyl]-2-fluoro-3-methylbenzamide
CID 81481242
2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide
CID 2864448
N-[3-(2-aminoethoxy)phenyl]-2,5-dichlorobenzamide
CID 63121176
3-[3-(2-aminoethoxy)phenyl]-1,1-dimethylurea
CID 79154063
N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide
CID 105062895
N-(3-acetylphenyl)-2,5-dimethylfuran-3-carboxamide
CID 4057606
5-methyl-N-(3-propoxyphenyl)furan-2-carboxamide
CID 2260679
N-[3-(2-aminoethoxy)phenyl]-2-bromo-4-chlorobenzamide
CID 103806449
N-[3-(2-aminoethoxy)phenyl]-2,5-dibromothiophene-3-carboxamide
CID 103806452
N-[3-(2-aminoethoxy)phenyl]-4-ethylbenzamide
CID 43369477
N-[3-(2-aminoethoxy)phenyl]-4-iodobenzamide
CID 63121269
N-[3-(2-aminoethoxy)phenyl]-2-methoxyacetamide
CID 61277360

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide?
The IUPAC name of N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide (CID 43175539) is N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide.
What is the SMILES notation for N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide?
The canonical SMILES for N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide is Cc1cc(C(=O)Nc2cccc(OCCN)c2)c(C)o1.
What is the InChIKey of N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide?
The InChIKey is LNWDYTXSNSIWMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-10-8-14(11(2)20-10)15(18)17-12-4-3-5-13(9-12)19-7-6-16/h3-5,8-9H,6-7,16H2,1-2H3,(H,17,18).
What are the key properties of N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide?
N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide is sourced from PubChem (CID 43175539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).