N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide

C21H18ClN3O — CID 109162396

IUPACN-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(N3CCc4ccccc43)nc2)cc1Cl
InChIInChI=1S/C21H18ClN3O/c1-14-6-8-17(12-18(14)22)24-21(26)16-7-9-20(23-13-16)25-11-10-15-4-2-3-5-19(15)25/h2-9,12-13H,10-11H2,1H3,(H,24,26)
InChIKeyQOPLECMAEJAREN-UHFFFAOYSA-N
MW363.85 g/mol
LogP4.99
Rot. Bonds3

About N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide

N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide (PubChem CID 109162396) has the molecular formula C21H18ClN3O and a molecular weight of 363.85 g/mol. Its IUPAC name is N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
PubChem CID109162396
Molecular FormulaC21H18ClN3O
Molecular Weight363.85 g/mol
Exact Mass363.11
IUPAC NameN-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(N3CCc4ccccc43)nc2)cc1Cl
InChIInChI=1S/C21H18ClN3O/c1-14-6-8-17(12-18(14)22)24-21(26)16-7-9-20(23-13-16)25-11-10-15-4-2-3-5-19(15)25/h2-9,12-13H,10-11H2,1H3,(H,24,26)
InChIKeyQOPLECMAEJAREN-UHFFFAOYSA-N
XLogP4.99
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.85
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-methoxy-5-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109162425
6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
CID 84570241
N-(4-chlorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide
CID 109162476
5-(2,3-dihydroindol-1-yl)-N-(3,4-dimethylphenyl)pyrazine-2-carboxamide
CID 109290481
3-chloro-N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzamide
CID 113016598
N-(3-chloro-4-methylphenyl)-6-(4-formylpiperazin-1-yl)pyridine-3-carboxamide
CID 109154932
6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide
CID 84570471
6-(2,3-dihydroindol-1-yl)-N-(4-methylpiperazin-1-yl)pyridine-3-carboxamide
CID 84570390
6-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109162480
N-(4-chlorophenyl)-2-(2,3-dihydroindol-1-yl)pyrimidine-5-carboxamide
CID 109266162
N-(3-chloro-4-fluorophenyl)-6-(2,3-dihydroindol-1-yl)-2-methylpyrimidine-4-carboxamide
CID 112848658
N-[2-(diethylamino)ethyl]-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84570324

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide (CID 109162396) is N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide is Cc1ccc(NC(=O)c2ccc(N3CCc4ccccc43)nc2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The InChIKey is QOPLECMAEJAREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClN3O/c1-14-6-8-17(12-18(14)22)24-21(26)16-7-9-20(23-13-16)25-11-10-15-4-2-3-5-19(15)25/h2-9,12-13H,10-11H2,1H3,(H,24,26).
What are the key properties of N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide has a molecular weight of 363.85 g/mol, XLogP of 4.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 109162396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).