7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide

C18H18N2O3 — CID 70226321

IUPAC7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide
SMILESCCCc1cc2c(C(=O)Nc3ccncc3)ccc(OC)c2o1
InChIInChI=1S/C18H18N2O3/c1-3-4-13-11-15-14(5-6-16(22-2)17(15)23-13)18(21)20-12-7-9-19-10-8-12/h5-11H,3-4H2,1-2H3,(H,19,20,21)
InChIKeyNVBDXUBNHOXTSU-UHFFFAOYSA-N
MW310.35 g/mol
LogP4.04
Rot. Bonds5

About 7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide

7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide (PubChem CID 70226321) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is 7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide.

Molecular Properties

Compound Name7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide
PubChem CID70226321
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide
SMILESCCCc1cc2c(C(=O)Nc3ccncc3)ccc(OC)c2o1
InChIInChI=1S/C18H18N2O3/c1-3-4-13-11-15-14(5-6-16(22-2)17(15)23-13)18(21)20-12-7-9-19-10-8-12/h5-11H,3-4H2,1-2H3,(H,19,20,21)
InChIKeyNVBDXUBNHOXTSU-UHFFFAOYSA-N
XLogP4.04
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-methoxy-N-phenyl-4-(2-pyridin-4-ylacetyl)-1-benzofuran-2-carboxamide
CID 22733923
ethane;4-ethyl-2-methoxy-N-pyridin-4-ylbenzamide
CID 167447261
2-(3-chloropropyl)-3,4-dimethoxy-N-pyridin-4-ylbenzamide
CID 66868075
7-methoxy-2,2-dimethyl-N-pyridin-4-yl-1,3-benzodioxole-4-carboxamide
CID 22734102
2-ethyl-7-methoxy-N-(3-methoxy-4-pyridinyl)furo[2,3-c]pyridine-4-carboxamide
CID 54172037
N-(4-butylphenyl)-2,3,4-trimethoxybenzamide
CID 9442096
4-hexoxy-3-methoxy-N-pyridin-4-ylbenzamide
CID 60589873
2-amino-6-methoxy-N-pyridin-4-ylbenzamide
CID 81410012
N-pyridin-4-yl-2-(3,4,5-trimethoxyphenyl)acetamide
CID 27700068
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-1,2-dihydroacenaphthylene-5-carboxamide
CID 46480702
N-(4-butylphenyl)-2,4,5-trimethoxybenzamide
CID 9442098
N-[4-(hydroxymethyl)phenyl]-7-methoxy-2-oxo-8-propylchromene-3-carboxamide
CID 52932181

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide?
The IUPAC name of 7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide (CID 70226321) is 7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide.
What is the SMILES notation for 7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide?
The canonical SMILES for 7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide is CCCc1cc2c(C(=O)Nc3ccncc3)ccc(OC)c2o1.
What is the InChIKey of 7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide?
The InChIKey is NVBDXUBNHOXTSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-3-4-13-11-15-14(5-6-16(22-2)17(15)23-13)18(21)20-12-7-9-19-10-8-12/h5-11H,3-4H2,1-2H3,(H,19,20,21).
What are the key properties of 7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide?
7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide has a molecular weight of 310.35 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-propyl-N-pyridin-4-yl-1-benzofuran-4-carboxamide is sourced from PubChem (CID 70226321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).