N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide

C22H18N4O — CID 109200837

IUPACN-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
SMILESCC1Cc2ccccc2N1c1ccc(C(=O)Nc2ccc(C#N)cc2)nc1
InChIInChI=1S/C22H18N4O/c1-15-12-17-4-2-3-5-21(17)26(15)19-10-11-20(24-14-19)22(27)25-18-8-6-16(13-23)7-9-18/h2-11,14-15H,12H2,1H3,(H,25,27)
InChIKeyPJPUFIJHTDVLNK-UHFFFAOYSA-N
MW354.41 g/mol
LogP4.29
Rot. Bonds3

About N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide

N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide (PubChem CID 109200837) has the molecular formula C22H18N4O and a molecular weight of 354.41 g/mol. Its IUPAC name is N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
PubChem CID109200837
Molecular FormulaC22H18N4O
Molecular Weight354.41 g/mol
Exact Mass354.15
IUPAC NameN-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide
SMILESCC1Cc2ccccc2N1c1ccc(C(=O)Nc2ccc(C#N)cc2)nc1
InChIInChI=1S/C22H18N4O/c1-15-12-17-4-2-3-5-21(17)26(15)19-10-11-20(24-14-19)22(27)25-18-8-6-16(13-23)7-9-18/h2-11,14-15H,12H2,1H3,(H,25,27)
InChIKeyPJPUFIJHTDVLNK-UHFFFAOYSA-N
XLogP4.29
TPSA69.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-cyanophenyl)-5-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide
CID 109197949
[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109181947
5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carbothioamide
CID 115488133
2,3-dihydroindol-1-yl-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methanone
CID 109197791
1-[4-(2-methyl-2,3-dihydroindol-1-yl)phenyl]-3-phenylurea
CID 112989569
5-(2-methyl-2,3-dihydroindol-1-yl)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109292034
5-(azepan-1-yl)-N-(4-cyanophenyl)pyridine-2-carboxamide
CID 109196949
5-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyridine-3-carboxamide
CID 109241516
N-(4-cyanophenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 2161891
N-(4-chlorophenyl)-6-(2-methyl-2,3-dihydroindol-1-yl)pyridazine-3-carboxamide
CID 109128795
N-[4-(2-methyl-2,3-dihydroindol-1-yl)phenyl]thiophene-2-carboxamide
CID 112989553
N-(4-fluorophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109244279

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide (CID 109200837) is N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide is CC1Cc2ccccc2N1c1ccc(C(=O)Nc2ccc(C#N)cc2)nc1.
What is the InChIKey of N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The InChIKey is PJPUFIJHTDVLNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O/c1-15-12-17-4-2-3-5-21(17)26(15)19-10-11-20(24-14-19)22(27)25-18-8-6-16(13-23)7-9-18/h2-11,14-15H,12H2,1H3,(H,25,27).
What are the key properties of N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide has a molecular weight of 354.41 g/mol, XLogP of 4.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 109200837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).