3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide

C22H18N2O4 — CID 7385763

IUPAC3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide
SMILESCCOc1ccc2ccccc2c1C(=O)Nc1c(C(N)=O)oc2ccccc12
InChIInChI=1S/C22H18N2O4/c1-2-27-17-12-11-13-7-3-4-8-14(13)18(17)22(26)24-19-15-9-5-6-10-16(15)28-20(19)21(23)25/h3-12H,2H2,1H3,(H2,23,25)(H,24,26)
InChIKeyVQABXBJEMOMKSG-UHFFFAOYSA-N
MW374.40 g/mol
LogP4.34
Rot. Bonds5

About 3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide

3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide (PubChem CID 7385763) has the molecular formula C22H18N2O4 and a molecular weight of 374.40 g/mol. Its IUPAC name is 3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide
PubChem CID7385763
Molecular FormulaC22H18N2O4
Molecular Weight374.40 g/mol
Exact Mass374.13
IUPAC Name3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide
SMILESCCOc1ccc2ccccc2c1C(=O)Nc1c(C(N)=O)oc2ccccc12
InChIInChI=1S/C22H18N2O4/c1-2-27-17-12-11-13-7-3-4-8-14(13)18(17)22(26)24-19-15-9-5-6-10-16(15)28-20(19)21(23)25/h3-12H,2H2,1H3,(H2,23,25)(H,24,26)
InChIKeyVQABXBJEMOMKSG-UHFFFAOYSA-N
XLogP4.34
TPSA94.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 54.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-(2-ethoxyphenoxy)butanoylamino]-1-benzofuran-2-carboxamide
CID 17436206
2-ethoxy-N-(2-ethoxypyrimidin-5-yl)naphthalene-1-carboxamide
CID 122301952
2-ethoxy-N-(2-propan-2-ylphenyl)naphthalene-1-carboxamide
CID 9497351
3-(pentanoylamino)-1-benzofuran-2-carboxamide
CID 7385691
3-[[2-(2-methoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide
CID 17409565
3-[[2-(3,4-diethoxyphenyl)acetyl]amino]-N-phenyl-1-benzofuran-2-carboxamide
CID 1267238
N-[(2S)-butan-2-yl]-2-ethoxynaphthalene-1-carboxamide
CID 9497386
2-ethoxy-N-[5-(2-methyl-1,3-thiazol-4-yl)-1,3,4-oxadiazol-2-yl]naphthalene-1-carboxamide
CID 90602796
3-amino-1-benzofuran-2-carboxamide;ethyl N-(2-carbamoyl-1-benzofuran-3-yl)carbamate;ethyl carbonochloridate
CID 162166212
N-[2-(3-chloro-4-ethoxybenzoyl)-1-benzofuran-3-yl]benzamide
CID 18829831
1-acetamidobenzo[e][1]benzofuran-2-carboxamide
CID 23148944
3-(2-ethoxynaphthalen-1-yl)-3-oxopropanoic acid
CID 170886868

Frequently Asked Questions

What is the IUPAC name of 3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide?
The IUPAC name of 3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide (CID 7385763) is 3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide.
What is the SMILES notation for 3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide?
The canonical SMILES for 3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide is CCOc1ccc2ccccc2c1C(=O)Nc1c(C(N)=O)oc2ccccc12.
What is the InChIKey of 3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide?
The InChIKey is VQABXBJEMOMKSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O4/c1-2-27-17-12-11-13-7-3-4-8-14(13)18(17)22(26)24-19-15-9-5-6-10-16(15)28-20(19)21(23)25/h3-12H,2H2,1H3,(H2,23,25)(H,24,26).
What are the key properties of 3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide?
3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide has a molecular weight of 374.40 g/mol, XLogP of 4.34, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-ethoxynaphthalene-1-carbonyl)amino]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 7385763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).