benzo[g][1]benzofuran;N-methylbutanamide

C17H19NO2 — CID 174308146

IUPACbenzo[g][1]benzofuran;N-methylbutanamide
SMILESCCCC(=O)NC.c1ccc2c(c1)ccc1ccoc12
InChIInChI=1S/C12H8O.C5H11NO/c1-2-4-11-9(3-1)5-6-10-7-8-13-12(10)11;1-3-4-5(7)6-2/h1-8H;3-4H2,1-2H3,(H,6,7)
InChIKeyNLNGDEPOCUTQFW-UHFFFAOYSA-N
MW269.34 g/mol
LogP4.12
Rot. Bonds2

About benzo[g][1]benzofuran;N-methylbutanamide

benzo[g][1]benzofuran;N-methylbutanamide (PubChem CID 174308146) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is benzo[g][1]benzofuran;N-methylbutanamide.

Molecular Properties

Compound Namebenzo[g][1]benzofuran;N-methylbutanamide
PubChem CID174308146
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Namebenzo[g][1]benzofuran;N-methylbutanamide
SMILESCCCC(=O)NC.c1ccc2c(c1)ccc1ccoc12
InChIInChI=1S/C12H8O.C5H11NO/c1-2-4-11-9(3-1)5-6-10-7-8-13-12(10)11;1-3-4-5(7)6-2/h1-8H;3-4H2,1-2H3,(H,6,7)
InChIKeyNLNGDEPOCUTQFW-UHFFFAOYSA-N
XLogP4.12
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzofuran-7-ol;methylcarbamic acid
CID 70538977
3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide
CID 62326134
7-(2-hydroxynaphthalen-1-yl)-1-benzofuran-6-ol
CID 163867392
N-benzo[g][1,3]benzothiazol-2-ylbutanamide
CID 5054800
N-naphtho[1,2-b]phenanthren-14-ylbutanamide
CID 90486931
N-methyl-3-naphthalen-2-ylpropanamide
CID 47293107
N-(naphthalen-1-ylcarbamothioyl)butanamide
CID 916625
N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 110323289
N-[4-(isoquinolin-1-ylmethyl)phenyl]butanamide
CID 67036636
3-[1-(1-hydroxynaphthalen-2-yl)ethyl-methylamino]-N-methylpropanamide
CID 105400787
ethyl benzo[e][1]benzofuran-4-carboxylate
CID 139258571
N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide
CID 47161001

Frequently Asked Questions

What is the IUPAC name of benzo[g][1]benzofuran;N-methylbutanamide?
The IUPAC name of benzo[g][1]benzofuran;N-methylbutanamide (CID 174308146) is benzo[g][1]benzofuran;N-methylbutanamide.
What is the SMILES notation for benzo[g][1]benzofuran;N-methylbutanamide?
The canonical SMILES for benzo[g][1]benzofuran;N-methylbutanamide is CCCC(=O)NC.c1ccc2c(c1)ccc1ccoc12.
What is the InChIKey of benzo[g][1]benzofuran;N-methylbutanamide?
The InChIKey is NLNGDEPOCUTQFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8O.C5H11NO/c1-2-4-11-9(3-1)5-6-10-7-8-13-12(10)11;1-3-4-5(7)6-2/h1-8H;3-4H2,1-2H3,(H,6,7).
What are the key properties of benzo[g][1]benzofuran;N-methylbutanamide?
benzo[g][1]benzofuran;N-methylbutanamide has a molecular weight of 269.34 g/mol, XLogP of 4.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzo[g][1]benzofuran;N-methylbutanamide is sourced from PubChem (CID 174308146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).