N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide

C18H22N2O5 — CID 46460724

IUPACN-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide
SMILESCCOc1ccc(C(C)NC(=O)CNC(=O)c2ccoc2)cc1OC
InChIInChI=1S/C18H22N2O5/c1-4-25-15-6-5-13(9-16(15)23-3)12(2)20-17(21)10-19-18(22)14-7-8-24-11-14/h5-9,11-12H,4,10H2,1-3H3,(H,19,22)(H,20,21)
InChIKeyYWWUJPJWTDEFPA-UHFFFAOYSA-N
MW346.38 g/mol
LogP2.29
Rot. Bonds8

About N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide

N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide (PubChem CID 46460724) has the molecular formula C18H22N2O5 and a molecular weight of 346.38 g/mol. Its IUPAC name is N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide
PubChem CID46460724
Molecular FormulaC18H22N2O5
Molecular Weight346.38 g/mol
Exact Mass346.15
IUPAC NameN-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide
SMILESCCOc1ccc(C(C)NC(=O)CNC(=O)c2ccoc2)cc1OC
InChIInChI=1S/C18H22N2O5/c1-4-25-15-6-5-13(9-16(15)23-3)12(2)20-17(21)10-19-18(22)14-7-8-24-11-14/h5-9,11-12H,4,10H2,1-3H3,(H,19,22)(H,20,21)
InChIKeyYWWUJPJWTDEFPA-UHFFFAOYSA-N
XLogP2.29
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.38
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(3,4-diethoxyphenyl)ethyl]furan-3-carboxamide
CID 46415111
N-[2-[1-(3,4-diethoxyphenyl)ethylamino]-2-oxoethyl]-4-fluorobenzamide
CID 46414977
2-ethoxy-N-[2-[1-(3-methoxy-4-propoxyphenyl)ethylamino]-2-oxoethyl]benzamide
CID 55845776
N-[(1R)-1-(3,4-diethoxyphenyl)ethyl]-2-(3,4-dimethoxyphenyl)sulfanylacetamide
CID 99950807
N-[2-[1-(3-bromo-4-methoxyphenyl)ethylamino]-2-oxoethyl]-3,4-dimethoxybenzamide
CID 46433680
N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]-4-methoxybenzamide
CID 46448222
N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]-2-(2-methoxyphenyl)acetamide
CID 46415728
N-[2-[(4-butoxy-3-methoxyphenyl)methylamino]-2-oxoethyl]furan-3-carboxamide
CID 39970273
2-chloro-N-[2-[[(1R)-1-(3,4-diethoxyphenyl)ethyl]amino]-2-oxoethyl]benzamide
CID 9418929
N-[2-oxo-2-(pentan-3-ylamino)ethyl]furan-3-carboxamide
CID 46431023
methyl 3-[[2-[(3,4-diethoxybenzoyl)amino]acetyl]amino]-3-(3,4-dimethoxyphenyl)propanoate
CID 55440713
N-[2-[[(1R)-1-(3,4-diethoxyphenyl)ethyl]amino]-2-oxoethyl]thiophene-2-carboxamide
CID 9418935

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide?
The IUPAC name of N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide (CID 46460724) is N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide.
What is the SMILES notation for N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide?
The canonical SMILES for N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide is CCOc1ccc(C(C)NC(=O)CNC(=O)c2ccoc2)cc1OC.
What is the InChIKey of N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide?
The InChIKey is YWWUJPJWTDEFPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O5/c1-4-25-15-6-5-13(9-16(15)23-3)12(2)20-17(21)10-19-18(22)14-7-8-24-11-14/h5-9,11-12H,4,10H2,1-3H3,(H,19,22)(H,20,21).
What are the key properties of N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide?
N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide has a molecular weight of 346.38 g/mol, XLogP of 2.29, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(4-ethoxy-3-methoxyphenyl)ethylamino]-2-oxoethyl]furan-3-carboxamide is sourced from PubChem (CID 46460724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).