N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide

C22H22N2O5 — CID 86821930

IUPACN-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide
SMILESCCOCc1ccccc1NC(=O)COc1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C22H22N2O5/c1-2-27-14-16-7-3-4-10-19(16)24-21(25)15-29-18-9-5-8-17(13-18)23-22(26)20-11-6-12-28-20/h3-13H,2,14-15H2,1H3,(H,23,26)(H,24,25)
InChIKeyQLCCGUVHSZMKOX-UHFFFAOYSA-N
MW394.43 g/mol
LogP4.09
Rot. Bonds9

About N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide

N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide (PubChem CID 86821930) has the molecular formula C22H22N2O5 and a molecular weight of 394.43 g/mol. Its IUPAC name is N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide
PubChem CID86821930
Molecular FormulaC22H22N2O5
Molecular Weight394.43 g/mol
Exact Mass394.15
IUPAC NameN-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide
SMILESCCOCc1ccccc1NC(=O)COc1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C22H22N2O5/c1-2-27-14-16-7-3-4-10-19(16)24-21(25)15-29-18-9-5-8-17(13-18)23-22(26)20-11-6-12-28-20/h3-13H,2,14-15H2,1H3,(H,23,26)(H,24,25)
InChIKeyQLCCGUVHSZMKOX-UHFFFAOYSA-N
XLogP4.09
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.43
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[2-[3-(furan-2-ylmethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 55933693
N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 56796448
N-[3-[2-(2-methoxyethylamino)-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 46547454
N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]furan-2-carboxamide
CID 1491636
N-[3-[2-[(2-amino-2-ethylbutyl)amino]-2-oxoethoxy]phenyl]furan-2-carboxamide;hydrochloride
CID 119642129
N-[3-[2-[[3-(2-methylbutanoylamino)phenyl]methylamino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 55868511
N-[3-[2-[(2-butylpyrazol-3-yl)amino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 52723980
N-[3-[2-[[(2S)-1-aminopropan-2-yl]amino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 120508274
ethyl N-[3-[2-(2-ethylanilino)-2-oxoethoxy]phenyl]carbamate
CID 30011225
N-[3-[[2-[2-(2-ethoxyethoxy)anilino]-2-oxoethyl]amino]phenyl]furan-2-carboxamide
CID 54843723
N-[3-[2-[[(2S)-1-aminopropan-2-yl]amino]-2-oxoethoxy]phenyl]furan-2-carboxamide;hydrochloride
CID 120508273
N-[3-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 78861839

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide (CID 86821930) is N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide is CCOCc1ccccc1NC(=O)COc1cccc(NC(=O)c2ccco2)c1.
What is the InChIKey of N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide?
The InChIKey is QLCCGUVHSZMKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O5/c1-2-27-14-16-7-3-4-10-19(16)24-21(25)15-29-18-9-5-8-17(13-18)23-22(26)20-11-6-12-28-20/h3-13H,2,14-15H2,1H3,(H,23,26)(H,24,25).
What are the key properties of N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide?
N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide has a molecular weight of 394.43 g/mol, XLogP of 4.09, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-[2-(ethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide is sourced from PubChem (CID 86821930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).