N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide

C21H30N2O4 — CID 78869073

IUPACN-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide
SMILESCCC(CC)C(CNC(=O)c1cc2cccc(OC)c2o1)N1CCOCC1
InChIInChI=1S/C21H30N2O4/c1-4-15(5-2)17(23-9-11-26-12-10-23)14-22-21(24)19-13-16-7-6-8-18(25-3)20(16)27-19/h6-8,13,15,17H,4-5,9-12,14H2,1-3H3,(H,22,24)
InChIKeyFVTXUSYNBJXMPJ-UHFFFAOYSA-N
MW374.48 g/mol
LogP3.31
Rot. Bonds8

About N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide

N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide (PubChem CID 78869073) has the molecular formula C21H30N2O4 and a molecular weight of 374.48 g/mol. Its IUPAC name is N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide
PubChem CID78869073
Molecular FormulaC21H30N2O4
Molecular Weight374.48 g/mol
Exact Mass374.22
IUPAC NameN-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide
SMILESCCC(CC)C(CNC(=O)c1cc2cccc(OC)c2o1)N1CCOCC1
InChIInChI=1S/C21H30N2O4/c1-4-15(5-2)17(23-9-11-26-12-10-23)14-22-21(24)19-13-16-7-6-8-18(25-3)20(16)27-19/h6-8,13,15,17H,4-5,9-12,14H2,1-3H3,(H,22,24)
InChIKeyFVTXUSYNBJXMPJ-UHFFFAOYSA-N
XLogP3.31
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.48
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-ethyl-2-morpholin-4-ylpentyl)-2,3-dimethoxybenzamide
CID 46529390
N-(3-ethyl-2-morpholin-4-ylpentyl)-2-(3-methoxy-4-methylphenyl)acetamide
CID 55548898
1-(3-ethyl-2-morpholin-4-ylpentyl)-3-(2-methoxyphenyl)urea
CID 24665000
N-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]-7-methoxy-1-benzofuran-2-carboxamide
CID 90613369
N-[2-(azetidin-1-yl)-2-thiophen-3-ylethyl]-7-methoxy-1-benzofuran-2-carboxamide
CID 91813433
N-(3-ethyl-2-morpholin-4-ylpentyl)-3-(methylsulfinylmethyl)benzamide
CID 134053135
4-(difluoromethoxy)-N-(3-ethyl-2-morpholin-4-ylpentyl)-3-methoxybenzamide
CID 43046344
7-methoxy-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]-1-benzofuran-2-carboxamide
CID 122318745
7-methoxy-N-[2-methoxy-2-(2-methylphenyl)ethyl]-1-benzofuran-2-carboxamide
CID 71810493
N-[(2R)-2-hydroxy-2-naphthalen-1-ylethyl]-7-methoxy-1-benzofuran-2-carboxamide
CID 95367182
N-(3-ethyl-2-morpholin-4-ylpentyl)-3-(4-methoxyphenyl)propanamide
CID 75691751
N-hexyl-7-methoxy-1-benzofuran-2-carboxamide
CID 78870029

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide?
The IUPAC name of N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide (CID 78869073) is N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide is CCC(CC)C(CNC(=O)c1cc2cccc(OC)c2o1)N1CCOCC1.
What is the InChIKey of N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide?
The InChIKey is FVTXUSYNBJXMPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N2O4/c1-4-15(5-2)17(23-9-11-26-12-10-23)14-22-21(24)19-13-16-7-6-8-18(25-3)20(16)27-19/h6-8,13,15,17H,4-5,9-12,14H2,1-3H3,(H,22,24).
What are the key properties of N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide?
N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide has a molecular weight of 374.48 g/mol, XLogP of 3.31, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-morpholin-4-ylpentyl)-7-methoxy-1-benzofuran-2-carboxamide is sourced from PubChem (CID 78869073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).