N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide

C20H19N3O2 — CID 109209427

IUPACN-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
SMILESCC1Cc2ccccc2N1c1ccnc(C(=O)NCc2ccco2)c1
InChIInChI=1S/C20H19N3O2/c1-14-11-15-5-2-3-7-19(15)23(14)16-8-9-21-18(12-16)20(24)22-13-17-6-4-10-25-17/h2-10,12,14H,11,13H2,1H3,(H,22,24)
InChIKeyNIYQAFNXWYHXFG-UHFFFAOYSA-N
MW333.39 g/mol
LogP3.69
Rot. Bonds4

About N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide

N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide (PubChem CID 109209427) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
PubChem CID109209427
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC NameN-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
SMILESCC1Cc2ccccc2N1c1ccnc(C(=O)NCc2ccco2)c1
InChIInChI=1S/C20H19N3O2/c1-14-11-15-5-2-3-7-19(15)23(14)16-8-9-21-18(12-16)20(24)22-13-17-6-4-10-25-17/h2-10,12,14H,11,13H2,1H3,(H,22,24)
InChIKeyNIYQAFNXWYHXFG-UHFFFAOYSA-N
XLogP3.69
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide (CID 109209427) is N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide is CC1Cc2ccccc2N1c1ccnc(C(=O)NCc2ccco2)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The InChIKey is NIYQAFNXWYHXFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-14-11-15-5-2-3-7-19(15)23(14)16-8-9-21-18(12-16)20(24)22-13-17-6-4-10-25-17/h2-10,12,14H,11,13H2,1H3,(H,22,24).
What are the key properties of N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 109209427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).