2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide

C19H19ClN2O2 — CID 23889660

IUPAC2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide
SMILESCC(C)(C)c1ccc2occ(CC(=O)Nc3ccc(Cl)cn3)c2c1
InChIInChI=1S/C19H19ClN2O2/c1-19(2,3)13-4-6-16-15(9-13)12(11-24-16)8-18(23)22-17-7-5-14(20)10-21-17/h4-7,9-11H,8H2,1-3H3,(H,21,22,23)
InChIKeyQJSARRTVOAFRSA-UHFFFAOYSA-N
MW342.83 g/mol
LogP4.96
Rot. Bonds3

About 2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide

2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide (PubChem CID 23889660) has the molecular formula C19H19ClN2O2 and a molecular weight of 342.83 g/mol. Its IUPAC name is 2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide
PubChem CID23889660
Molecular FormulaC19H19ClN2O2
Molecular Weight342.83 g/mol
Exact Mass342.11
IUPAC Name2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide
SMILESCC(C)(C)c1ccc2occ(CC(=O)Nc3ccc(Cl)cn3)c2c1
InChIInChI=1S/C19H19ClN2O2/c1-19(2,3)13-4-6-16-15(9-13)12(11-24-16)8-18(23)22-17-7-5-14(20)10-21-17/h4-7,9-11H,8H2,1-3H3,(H,21,22,23)
InChIKeyQJSARRTVOAFRSA-UHFFFAOYSA-N
XLogP4.96
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.83
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-tert-butyl-1-benzofuran-3-yl)-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 18861285
N-(5-bromo-2-pyridinyl)-2-(5-methyl-1-benzofuran-3-yl)acetamide
CID 156620523
N-(1,3-benzothiazol-2-yl)-2-(5-tert-butyl-1-benzofuran-3-yl)acetamide
CID 23833458
2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
CID 18861274
2-(5-chloro-1-benzofuran-3-yl)-N-(3,4-dimethylphenyl)acetamide
CID 18860311
2-(5-tert-butyl-1-benzofuran-3-yl)-N-[4-[ethyl(2-hydroxyethyl)amino]phenyl]acetamide
CID 23833451
[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] 2-(6-methoxy-1-benzofuran-3-yl)acetate
CID 4210410
2-(5-chloro-1-benzofuran-3-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 18860950
N-(5-chloro-2-pyridinyl)-2-(2-methylphenyl)acetamide
CID 6464449
2-[[2-(5-tert-butyl-1-benzofuran-3-yl)acetyl]amino]-N-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 18861247
methyl 2-[[2-(5-tert-butyl-1-benzofuran-3-yl)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
CID 18861266
N-(5-chloro-2-pyridinyl)-1-[2-(5,6-dimethyl-1-benzofuran-3-yl)acetyl]piperidine-4-carboxamide
CID 55813157

Frequently Asked Questions

What is the IUPAC name of 2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide?
The IUPAC name of 2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide (CID 23889660) is 2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide?
The canonical SMILES for 2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide is CC(C)(C)c1ccc2occ(CC(=O)Nc3ccc(Cl)cn3)c2c1.
What is the InChIKey of 2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide?
The InChIKey is QJSARRTVOAFRSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O2/c1-19(2,3)13-4-6-16-15(9-13)12(11-24-16)8-18(23)22-17-7-5-14(20)10-21-17/h4-7,9-11H,8H2,1-3H3,(H,21,22,23).
What are the key properties of 2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide?
2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide has a molecular weight of 342.83 g/mol, XLogP of 4.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-tert-butyl-1-benzofuran-3-yl)-N-(5-chloro-2-pyridinyl)acetamide is sourced from PubChem (CID 23889660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).