N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide

C23H22FN3O — CID 109214008

IUPACN-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
SMILESCC1Cc2ccccc2N1c1ccnc(C(=O)NCCc2ccccc2F)c1
InChIInChI=1S/C23H22FN3O/c1-16-14-18-7-3-5-9-22(18)27(16)19-11-13-25-21(15-19)23(28)26-12-10-17-6-2-4-8-20(17)24/h2-9,11,13,15-16H,10,12,14H2,1H3,(H,26,28)
InChIKeyXOZGNRPAHIDISF-UHFFFAOYSA-N
MW375.45 g/mol
LogP4.28
Rot. Bonds5

About N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide

N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide (PubChem CID 109214008) has the molecular formula C23H22FN3O and a molecular weight of 375.45 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
PubChem CID109214008
Molecular FormulaC23H22FN3O
Molecular Weight375.45 g/mol
Exact Mass375.17
IUPAC NameN-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
SMILESCC1Cc2ccccc2N1c1ccnc(C(=O)NCCc2ccccc2F)c1
InChIInChI=1S/C23H22FN3O/c1-16-14-18-7-3-5-9-22(18)27(16)19-11-13-25-21(15-19)23(28)26-12-10-17-6-2-4-8-20(17)24/h2-9,11,13,15-16H,10,12,14H2,1H3,(H,26,28)
InChIKeyXOZGNRPAHIDISF-UHFFFAOYSA-N
XLogP4.28
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.45
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-2-carboxamide
CID 109210024
4-(2-methyl-2,3-dihydroindol-1-yl)-N-prop-2-enylpyridine-2-carboxamide
CID 109202250
N-(furan-2-ylmethyl)-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109209427
N-[2-(4-fluorophenyl)ethyl]-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-4-carboxamide
CID 109172647
N-[2-(2-fluorophenyl)ethyl]-2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoacetamide
CID 108985287
N-[2-(1H-indol-3-yl)ethyl]-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-4-carboxamide
CID 109309678
3,4-dihydro-1H-isoquinolin-2-yl-[4-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methanone
CID 109213833
4-N-[2-(2-fluorophenyl)ethyl]-2-N-pentylpyridine-2,4-dicarboxamide
CID 109087942
4-N-[3-(dimethylamino)propyl]-2-N-[2-(2-fluorophenyl)ethyl]pyridine-2,4-dicarboxamide
CID 109083889
N-[2-(2-fluorophenyl)ethyl]-4-(pentylamino)pyridine-2-carboxamide
CID 109213953
4-N-ethyl-2-N-[2-(2-fluorophenyl)ethyl]-4-N-phenylpyridine-2,4-dicarboxamide
CID 109088003
2-(2-methyl-2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
CID 109169666

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide (CID 109214008) is N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide is CC1Cc2ccccc2N1c1ccnc(C(=O)NCCc2ccccc2F)c1.
What is the InChIKey of N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The InChIKey is XOZGNRPAHIDISF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22FN3O/c1-16-14-18-7-3-5-9-22(18)27(16)19-11-13-25-21(15-19)23(28)26-12-10-17-6-2-4-8-20(17)24/h2-9,11,13,15-16H,10,12,14H2,1H3,(H,26,28).
What are the key properties of N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide has a molecular weight of 375.45 g/mol, XLogP of 4.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)ethyl]-4-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 109214008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).