N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide

C18H24N2O4 — CID 8960895

IUPACN-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide
SMILESCCN(CC(=O)NC(C)C)C(=O)c1oc2ccc(OC)cc2c1C
InChIInChI=1S/C18H24N2O4/c1-6-20(10-16(21)19-11(2)3)18(22)17-12(4)14-9-13(23-5)7-8-15(14)24-17/h7-9,11H,6,10H2,1-5H3,(H,19,21)
InChIKeyUUWJWINDJCAVJY-UHFFFAOYSA-N
MW332.40 g/mol
LogP2.74
Rot. Bonds6

About N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide

N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide (PubChem CID 8960895) has the molecular formula C18H24N2O4 and a molecular weight of 332.40 g/mol. Its IUPAC name is N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide
PubChem CID8960895
Molecular FormulaC18H24N2O4
Molecular Weight332.40 g/mol
Exact Mass332.17
IUPAC NameN-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide
SMILESCCN(CC(=O)NC(C)C)C(=O)c1oc2ccc(OC)cc2c1C
InChIInChI=1S/C18H24N2O4/c1-6-20(10-16(21)19-11(2)3)18(22)17-12(4)14-9-13(23-5)7-8-15(14)24-17/h7-9,11H,6,10H2,1-5H3,(H,19,21)
InChIKeyUUWJWINDJCAVJY-UHFFFAOYSA-N
XLogP2.74
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methoxy-N,3-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide
CID 8820536
N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-5-methoxy-3-methyl-1-benzofuran-2-carboxamide
CID 8960631
methyl 2-[ethyl-(5-fluoro-3-methyl-1-benzofuran-2-carbonyl)amino]acetate
CID 61383254
N-ethyl-4-methoxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 47105894
N-ethyl-2,4-dimethoxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 51172774
5-methoxy-N-[(2R)-2-methoxypropyl]-N,3-dimethyl-1-benzofuran-2-carboxamide
CID 51597039
N-ethyl-6-methoxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]quinoline-2-carboxamide
CID 24586114
diethyl 2-[(5-methoxy-3-methyl-1-benzofuran-2-carbonyl)amino]propanedioate
CID 55466367
[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl] 5-methoxy-3-methyl-1-benzofuran-2-carboxylate
CID 55399755
5-methoxy-3-methyl-N-[2-(propan-2-ylcarbamoylamino)phenyl]-1-benzofuran-2-carboxamide
CID 55964822
N-[[4-(diethylaminomethyl)phenyl]methyl]-5-methoxy-3-methyl-1-benzofuran-2-carboxamide
CID 8948017
ethyl 2-[(5-bromo-3-methyl-1-benzofuran-2-carbonyl)-ethylamino]acetate
CID 78901773

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide (CID 8960895) is N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide is CCN(CC(=O)NC(C)C)C(=O)c1oc2ccc(OC)cc2c1C.
What is the InChIKey of N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide?
The InChIKey is UUWJWINDJCAVJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O4/c1-6-20(10-16(21)19-11(2)3)18(22)17-12(4)14-9-13(23-5)7-8-15(14)24-17/h7-9,11H,6,10H2,1-5H3,(H,19,21).
What are the key properties of N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide?
N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide has a molecular weight of 332.40 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methoxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 8960895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).