N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide

C17H21NO3 — CID 1130073

IUPACN-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide
SMILESCOc1ccc2oc(C)c(C(=O)NC3CCCCC3)c2c1
InChIInChI=1S/C17H21NO3/c1-11-16(17(19)18-12-6-4-3-5-7-12)14-10-13(20-2)8-9-15(14)21-11/h8-10,12H,3-7H2,1-2H3,(H,18,19)
InChIKeyZGLXZFNEQVVYHJ-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.81
Rot. Bonds3

About N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide

N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide (PubChem CID 1130073) has the molecular formula C17H21NO3 and a molecular weight of 287.36 g/mol. Its IUPAC name is N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide
PubChem CID1130073
Molecular FormulaC17H21NO3
Molecular Weight287.36 g/mol
Exact Mass287.15
IUPAC NameN-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide
SMILESCOc1ccc2oc(C)c(C(=O)NC3CCCCC3)c2c1
InChIInChI=1S/C17H21NO3/c1-11-16(17(19)18-12-6-4-3-5-7-12)14-10-13(20-2)8-9-15(14)21-11/h8-10,12H,3-7H2,1-2H3,(H,18,19)
InChIKeyZGLXZFNEQVVYHJ-UHFFFAOYSA-N
XLogP3.81
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-5-methoxy-3-methyl-1-benzofuran-2-carboxamide
CID 2671520
5-(cyclopropylmethoxy)-2-methyl-N-(1-methylpiperidin-4-yl)-1-benzofuran-3-carboxamide
CID 175963546
N-[(1-hydroxycyclopentyl)methyl]-5-methoxy-2-methyl-1-benzofuran-3-carboxamide
CID 111331196
1-cyclopentyl-3-[(5-methoxy-3-methyl-1-benzofuran-2-carbonyl)amino]thiourea
CID 9090114
2-[(5-methoxy-2-methyl-1-benzofuran-3-carbonyl)amino]propanoic acid
CID 82043387
N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide
CID 55787551
N-cycloheptyl-7-methoxy-4-oxochromene-2-carboxamide
CID 51998192
N-cyclohexyl-7-methoxy-4-oxochromene-2-carboxamide
CID 51998191
4-[(5-methoxy-2-methyl-1-benzofuran-3-carbonyl)amino]butanoic acid
CID 13415654
N-(1-ethylpiperidin-4-yl)-2-methyl-5-phenylmethoxy-1-benzofuran-3-carboxamide
CID 163379581
5-methoxy-2-methyl-N-[3-(3-methylphenoxy)propyl]-1-benzofuran-3-carboxamide
CID 55789548
2-methyl-N-(oxetan-3-yl)-5-phenylmethoxy-1-benzofuran-3-carboxamide
CID 163379359

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide?
The IUPAC name of N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide (CID 1130073) is N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide?
The canonical SMILES for N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide is COc1ccc2oc(C)c(C(=O)NC3CCCCC3)c2c1.
What is the InChIKey of N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide?
The InChIKey is ZGLXZFNEQVVYHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO3/c1-11-16(17(19)18-12-6-4-3-5-7-12)14-10-13(20-2)8-9-15(14)21-11/h8-10,12H,3-7H2,1-2H3,(H,18,19).
What are the key properties of N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide?
N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide has a molecular weight of 287.36 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide is sourced from PubChem (CID 1130073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).