N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide

C20H16N2O2 — CID 121363846

IUPACN-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide
SMILESC[C@@H](NC(=O)c1ccc2c(c1)oc1cnccc12)c1ccccc1
InChIInChI=1S/C20H16N2O2/c1-13(14-5-3-2-4-6-14)22-20(23)15-7-8-16-17-9-10-21-12-19(17)24-18(16)11-15/h2-13H,1H3,(H,22,23)/t13-/m1/s1
InChIKeyQNJJZWIGOIKFRY-CYBMUJFWSA-N
MW316.36 g/mol
LogP4.47
Rot. Bonds3

About N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide

N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide (PubChem CID 121363846) has the molecular formula C20H16N2O2 and a molecular weight of 316.36 g/mol. Its IUPAC name is N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide
PubChem CID121363846
Molecular FormulaC20H16N2O2
Molecular Weight316.36 g/mol
Exact Mass316.12
IUPAC NameN-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide
SMILESC[C@@H](NC(=O)c1ccc2c(c1)oc1cnccc12)c1ccccc1
InChIInChI=1S/C20H16N2O2/c1-13(14-5-3-2-4-6-14)22-20(23)15-7-8-16-17-9-10-21-12-19(17)24-18(16)11-15/h2-13H,1H3,(H,22,23)/t13-/m1/s1
InChIKeyQNJJZWIGOIKFRY-CYBMUJFWSA-N
XLogP4.47
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide?
The IUPAC name of N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide (CID 121363846) is N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide.
What is the SMILES notation for N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide?
The canonical SMILES for N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide is C[C@@H](NC(=O)c1ccc2c(c1)oc1cnccc12)c1ccccc1.
What is the InChIKey of N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide?
The InChIKey is QNJJZWIGOIKFRY-CYBMUJFWSA-N. The full InChI is InChI=1S/C20H16N2O2/c1-13(14-5-3-2-4-6-14)22-20(23)15-7-8-16-17-9-10-21-12-19(17)24-18(16)11-15/h2-13H,1H3,(H,22,23)/t13-/m1/s1.
What are the key properties of N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide?
N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide has a molecular weight of 316.36 g/mol, XLogP of 4.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-phenylethyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide is sourced from PubChem (CID 121363846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).