N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide

C21H18ClN3O — CID 109189865

IUPACN-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
SMILESO=C(NCc1ccccc1Cl)c1ccc(N2CCc3ccccc32)cn1
InChIInChI=1S/C21H18ClN3O/c22-18-7-3-1-6-16(18)13-24-21(26)19-10-9-17(14-23-19)25-12-11-15-5-2-4-8-20(15)25/h1-10,14H,11-13H2,(H,24,26)
InChIKeyZLFBYOGZYPWKKS-UHFFFAOYSA-N
MW363.85 g/mol
LogP4.36
Rot. Bonds4

About N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide

N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide (PubChem CID 109189865) has the molecular formula C21H18ClN3O and a molecular weight of 363.85 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
PubChem CID109189865
Molecular FormulaC21H18ClN3O
Molecular Weight363.85 g/mol
Exact Mass363.11
IUPAC NameN-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
SMILESO=C(NCc1ccccc1Cl)c1ccc(N2CCc3ccccc32)cn1
InChIInChI=1S/C21H18ClN3O/c22-18-7-3-1-6-16(18)13-24-21(26)19-10-9-17(14-23-19)25-12-11-15-5-2-4-8-20(15)25/h1-10,14H,11-13H2,(H,24,26)
InChIKeyZLFBYOGZYPWKKS-UHFFFAOYSA-N
XLogP4.36
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.85
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)pyrimidine-4-carboxamide
CID 109305878
N-[(2-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)-6-methylpyrimidine-4-carboxamide
CID 109328917
5-(2,3-dihydroindol-1-yl)-N-[(2-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109280007
N-(3-acetamidophenyl)-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109197843
5-(2,3-dihydroindol-1-yl)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109197830
5-(2,3-dihydroindol-1-yl)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109197827
N-(4-chloro-2-methoxy-5-methylphenyl)-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109197861
5-amino-N-[(2-chlorophenyl)methyl]pyrazine-2-carboxamide
CID 113381834
(4-benzylpiperazin-1-yl)-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]methanone
CID 109193357
1-[5-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)-2-pyridinyl]ethanone
CID 83120051
6-(2,3-dihydroindol-1-yl)-N-[(2-fluorophenyl)methyl]pyrimidine-4-carboxamide
CID 109348179
N-(1,3-benzodioxol-5-yl)-5-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide
CID 109197942

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide (CID 109189865) is N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide is O=C(NCc1ccccc1Cl)c1ccc(N2CCc3ccccc32)cn1.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
The InChIKey is ZLFBYOGZYPWKKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClN3O/c22-18-7-3-1-6-16(18)13-24-21(26)19-10-9-17(14-23-19)25-12-11-15-5-2-4-8-20(15)25/h1-10,14H,11-13H2,(H,24,26).
What are the key properties of N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide?
N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide has a molecular weight of 363.85 g/mol, XLogP of 4.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 109189865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).