N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide

C15H18N2O2 — CID 28770064

IUPACN-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide
SMILESCCc1ccc(N(CCN)C(=O)c2ccco2)cc1
InChIInChI=1S/C15H18N2O2/c1-2-12-5-7-13(8-6-12)17(10-9-16)15(18)14-4-3-11-19-14/h3-8,11H,2,9-10,16H2,1H3
InChIKeyNRYSFTDACUBPHB-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.45
Rot. Bonds5

About N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide

N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide (PubChem CID 28770064) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide
PubChem CID28770064
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide
SMILESCCc1ccc(N(CCN)C(=O)c2ccco2)cc1
InChIInChI=1S/C15H18N2O2/c1-2-12-5-7-13(8-6-12)17(10-9-16)15(18)14-4-3-11-19-14/h3-8,11H,2,9-10,16H2,1H3
InChIKeyNRYSFTDACUBPHB-UHFFFAOYSA-N
XLogP2.45
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-N-(3-fluorophenyl)furan-2-carboxamide
CID 28769132
N-(2-aminoethyl)-N-ethylfuran-2-carboxamide
CID 28707635
N-(2-aminoethyl)-N-(4-ethylphenyl)-2-methylpropanamide
CID 28770054
3-[N-(furan-2-carbonyl)anilino]propanoic acid
CID 28764053
3-[N-(furan-2-carbonyl)-3,4-dimethylanilino]propanoic acid
CID 82321480
N-(2-aminophenyl)-N-propylfuran-2-carboxamide
CID 63230481
N-(2-aminoethyl)-N-(2,2-difluoroethyl)furan-2-carboxamide
CID 107493246
3-[4-fluoro-N-(furan-2-carbonyl)anilino]-2-methylpropanoic acid
CID 82321510
N-[4-[2-(ethylamino)-2-oxoethyl]phenyl]-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide
CID 46045640
N-(4-chlorophenyl)-N-[(4-nitrophenyl)methyl]furan-2-carboxamide
CID 1117372
N-benzyl-N-[4-[2-(benzylamino)-2-oxoethyl]phenyl]furan-2-carboxamide
CID 46045761
N-butyl-N-methylfuran-2-carboxamide
CID 60670878

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide?
The IUPAC name of N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide (CID 28770064) is N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide is CCc1ccc(N(CCN)C(=O)c2ccco2)cc1.
What is the InChIKey of N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide?
The InChIKey is NRYSFTDACUBPHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-2-12-5-7-13(8-6-12)17(10-9-16)15(18)14-4-3-11-19-14/h3-8,11H,2,9-10,16H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide?
N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-(4-ethylphenyl)furan-2-carboxamide is sourced from PubChem (CID 28770064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).