N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide

C24H22N2O2 — CID 18830949

IUPACN-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide
SMILESCc1cc2oc(C(=O)N(Cc3ccccc3)c3ccccn3)c(C)c2cc1C
InChIInChI=1S/C24H22N2O2/c1-16-13-20-18(3)23(28-21(20)14-17(16)2)24(27)26(22-11-7-8-12-25-22)15-19-9-5-4-6-10-19/h4-14H,15H2,1-3H3
InChIKeyHGTYXHPTPFJNGX-UHFFFAOYSA-N
MW370.45 g/mol
LogP5.60
Rot. Bonds4

About N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide

N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide (PubChem CID 18830949) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide
PubChem CID18830949
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC NameN-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide
SMILESCc1cc2oc(C(=O)N(Cc3ccccc3)c3ccccn3)c(C)c2cc1C
InChIInChI=1S/C24H22N2O2/c1-16-13-20-18(3)23(28-21(20)14-17(16)2)24(27)26(22-11-7-8-12-25-22)15-19-9-5-4-6-10-19/h4-14H,15H2,1-3H3
InChIKeyHGTYXHPTPFJNGX-UHFFFAOYSA-N
XLogP5.60
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.45
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3,6-dimethyl-N-[(4-methylphenyl)methyl]-N-pyridin-2-yl-1-benzofuran-2-carboxamide
CID 35573006
3,5,7-trimethyl-N-pyridin-2-yl-N-[(3,4,5-trimethoxyphenyl)methyl]-1-benzofuran-2-carboxamide
CID 35578892
N-[(3,4-dimethoxyphenyl)methyl]-3,4,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide
CID 35573519
N-[(2-fluorophenyl)methyl]-3,5,7-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide
CID 35578886
3,5,6-trimethyl-N-(3-methyl-2-pyridinyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 35572978
N-benzyl-2,4-dimethyl-N-pyridin-2-ylpyrimidine-5-carboxamide
CID 84596527
N-[[4-(dimethylamino)phenyl]methyl]-7,8-dimethyl-4-oxo-N-pyridin-2-ylchromene-2-carboxamide
CID 35574237
ethyl 1-benzyl-4-[benzyl(pyridin-2-yl)carbamoyl]-3,5-dimethylpyrrole-2-carboxylate
CID 43954525
5-bromo-N,3-dimethyl-N-(pyridin-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 71888966
N-benzyl-2-(3,4-dimethylphenoxy)-N-pyridin-2-ylpropanamide
CID 18830895
N-benzyl-3-nitro-N-pyridin-2-ylbenzamide
CID 799327
N-benzyl-2-methoxy-N-pyridin-2-ylacetamide
CID 798237

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide?
The IUPAC name of N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide (CID 18830949) is N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide?
The canonical SMILES for N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide is Cc1cc2oc(C(=O)N(Cc3ccccc3)c3ccccn3)c(C)c2cc1C.
What is the InChIKey of N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide?
The InChIKey is HGTYXHPTPFJNGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-16-13-20-18(3)23(28-21(20)14-17(16)2)24(27)26(22-11-7-8-12-25-22)15-19-9-5-4-6-10-19/h4-14H,15H2,1-3H3.
What are the key properties of N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide?
N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide has a molecular weight of 370.45 g/mol, XLogP of 5.60, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3,5,6-trimethyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 18830949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).