N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide

C24H35NO2 — CID 118730982

IUPACN-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide
SMILESCCCCCCCCCCCC(=O)Nc1ccc2oc3c(c2c1)CCCC3
InChIInChI=1S/C24H35NO2/c1-2-3-4-5-6-7-8-9-10-15-24(26)25-19-16-17-23-21(18-19)20-13-11-12-14-22(20)27-23/h16-18H,2-15H2,1H3,(H,25,26)
InChIKeyUIILPMZEYOJORE-UHFFFAOYSA-N
MW369.55 g/mol
LogP7.17
Rot. Bonds11

About N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide

N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide (PubChem CID 118730982) has the molecular formula C24H35NO2 and a molecular weight of 369.55 g/mol. Its IUPAC name is N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide.

Molecular Properties

Compound NameN-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide
PubChem CID118730982
Molecular FormulaC24H35NO2
Molecular Weight369.55 g/mol
Exact Mass369.27
IUPAC NameN-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide
SMILESCCCCCCCCCCCC(=O)Nc1ccc2oc3c(c2c1)CCCC3
InChIInChI=1S/C24H35NO2/c1-2-3-4-5-6-7-8-9-10-15-24(26)25-19-16-17-23-21(18-19)20-13-11-12-14-22(20)27-23/h16-18H,2-15H2,1H3,(H,25,26)
InChIKeyUIILPMZEYOJORE-UHFFFAOYSA-N
XLogP7.17
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.55
LogP ≤ 57.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-Dibenzofuranamine
CID 19405
Acetamide, N-3-dibenzofuranyl-
CID 22087
N-(4-acetylphenyl)-1-benzofuran-2-carboxamide
CID 675185
2-(3-Methyl-4-Oxo-3,4-Dihydrophthalazin-1-Yl)-N-(6,7,8,9-Tetrahydrodibenzo[b,D]furan-2-Yl)acetamide
CID 71552341
N-(3-methylphenyl)-1-benzofuran-2-carboxamide
CID 725661
Butyl 3-[(1-benzofuran-2-ylcarbonyl)amino]benzoate
CID 1567373
4-{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-benzofuran-5-ylamino}-benzonitrile
CID 11573764
3-{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-benzofuran-5-ylamino}-benzonitrile
CID 11681731
N-(4-Benzofuran-4-ylmethyl-phenyl)-butyramide
CID 44264909
4-(5-(125I)iodo-1-benzofuran-2-yl)-N-methyl(125I)aniline
CID 71451875
3-[[2-Benzofuranyl(oxo)methyl]amino]benzoic acid ethyl ester
CID 682562
3-[(Benzofuran-2-carbonyl)-amino]-benzoic acid methyl ester
CID 684790

Frequently Asked Questions

What is the IUPAC name of N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide?
The IUPAC name of N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide (CID 118730982) is N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide.
What is the SMILES notation for N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide?
The canonical SMILES for N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide is CCCCCCCCCCCC(=O)Nc1ccc2oc3c(c2c1)CCCC3.
What is the InChIKey of N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide?
The InChIKey is UIILPMZEYOJORE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H35NO2/c1-2-3-4-5-6-7-8-9-10-15-24(26)25-19-16-17-23-21(18-19)20-13-11-12-14-22(20)27-23/h16-18H,2-15H2,1H3,(H,25,26).
What are the key properties of N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide?
N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide has a molecular weight of 369.55 g/mol, XLogP of 7.17, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)dodecanamide is sourced from PubChem (CID 118730982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).