N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide

C22H20N2O2 — CID 58639666

IUPACN-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccccc1-c1ccc(C(=O)Nc2ccc3c(c2)CCC3)cn1
InChIInChI=1S/C22H20N2O2/c1-26-21-8-3-2-7-19(21)20-12-10-17(14-23-20)22(25)24-18-11-9-15-5-4-6-16(15)13-18/h2-3,7-14H,4-6H2,1H3,(H,24,25)
InChIKeyGSSACDIDODBAFT-UHFFFAOYSA-N
MW344.41 g/mol
LogP4.50
Rot. Bonds4

About N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide

N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide (PubChem CID 58639666) has the molecular formula C22H20N2O2 and a molecular weight of 344.41 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide
PubChem CID58639666
Molecular FormulaC22H20N2O2
Molecular Weight344.41 g/mol
Exact Mass344.15
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccccc1-c1ccc(C(=O)Nc2ccc3c(c2)CCC3)cn1
InChIInChI=1S/C22H20N2O2/c1-26-21-8-3-2-7-19(21)20-12-10-17(14-23-20)22(25)24-18-11-9-15-5-4-6-16(15)13-18/h2-3,7-14H,4-6H2,1H3,(H,24,25)
InChIKeyGSSACDIDODBAFT-UHFFFAOYSA-N
XLogP4.50
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide (CID 58639666) is N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide is COc1ccccc1-c1ccc(C(=O)Nc2ccc3c(c2)CCC3)cn1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide?
The InChIKey is GSSACDIDODBAFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O2/c1-26-21-8-3-2-7-19(21)20-12-10-17(14-23-20)22(25)24-18-11-9-15-5-4-6-16(15)13-18/h2-3,7-14H,4-6H2,1H3,(H,24,25).
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide?
N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide has a molecular weight of 344.41 g/mol, XLogP of 4.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-6-(2-methoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 58639666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).