N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide

C21H17ClN2O2 — CID 46944217

IUPACN-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESO=C(NCc1cccc(Cl)c1)C1Cc2c(-c3ccccc3)ccnc2O1
InChIInChI=1S/C21H17ClN2O2/c22-16-8-4-5-14(11-16)13-24-20(25)19-12-18-17(9-10-23-21(18)26-19)15-6-2-1-3-7-15/h1-11,19H,12-13H2,(H,24,25)
InChIKeyRHVWMHMPWFGILM-UHFFFAOYSA-N
MW364.83 g/mol
LogP4.02
Rot. Bonds4

About N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide

N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (PubChem CID 46944217) has the molecular formula C21H17ClN2O2 and a molecular weight of 364.83 g/mol. Its IUPAC name is N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
PubChem CID46944217
Molecular FormulaC21H17ClN2O2
Molecular Weight364.83 g/mol
Exact Mass364.10
IUPAC NameN-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide
SMILESO=C(NCc1cccc(Cl)c1)C1Cc2c(-c3ccccc3)ccnc2O1
InChIInChI=1S/C21H17ClN2O2/c22-16-8-4-5-14(11-16)13-24-20(25)19-12-18-17(9-10-23-21(18)26-19)15-6-2-1-3-7-15/h1-11,19H,12-13H2,(H,24,25)
InChIKeyRHVWMHMPWFGILM-UHFFFAOYSA-N
XLogP4.02
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.83
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The IUPAC name of N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide (CID 46944217) is N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is O=C(NCc1cccc(Cl)c1)C1Cc2c(-c3ccccc3)ccnc2O1.
What is the InChIKey of N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
The InChIKey is RHVWMHMPWFGILM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN2O2/c22-16-8-4-5-14(11-16)13-24-20(25)19-12-18-17(9-10-23-21(18)26-19)15-6-2-1-3-7-15/h1-11,19H,12-13H2,(H,24,25).
What are the key properties of N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide?
N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide has a molecular weight of 364.83 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-chlorophenyl)methyl]-4-phenyl-2,3-dihydrofuro[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 46944217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).