5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide

C23H22N4O — CID 109237696

IUPAC5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2cncc(NCCc3c[nH]c4ccccc34)c2)cc1
InChIInChI=1S/C23H22N4O/c1-16-6-8-19(9-7-16)27-23(28)18-12-20(15-24-13-18)25-11-10-17-14-26-22-5-3-2-4-21(17)22/h2-9,12-15,25-26H,10-11H2,1H3,(H,27,28)
InChIKeyWPJLLKZGESOQQC-UHFFFAOYSA-N
MW370.46 g/mol
LogP4.78
Rot. Bonds6

About 5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide

5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide (PubChem CID 109237696) has the molecular formula C23H22N4O and a molecular weight of 370.46 g/mol. Its IUPAC name is 5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide
PubChem CID109237696
Molecular FormulaC23H22N4O
Molecular Weight370.46 g/mol
Exact Mass370.18
IUPAC Name5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2cncc(NCCc3c[nH]c4ccccc34)c2)cc1
InChIInChI=1S/C23H22N4O/c1-16-6-8-19(9-7-16)27-23(28)18-12-20(15-24-13-18)25-11-10-17-14-26-22-5-3-2-4-21(17)22/h2-9,12-15,25-26H,10-11H2,1H3,(H,27,28)
InChIKeyWPJLLKZGESOQQC-UHFFFAOYSA-N
XLogP4.78
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 54.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-5-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
CID 109237714
5-[2-(1H-indol-3-yl)ethylamino]-N-(2-methoxyethyl)pyridine-3-carboxamide
CID 109227676
N-cyclopropyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
CID 109223605
5-[2-(1H-indol-3-yl)ethylamino]-N-pentylpyridine-3-carboxamide
CID 109237687
4-[2-(1H-indol-3-yl)ethylamino]-N-pyridin-4-ylbenzamide
CID 59555813
N-[2-(1H-indol-3-yl)ethyl]-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109228227
5-[2-(1H-indol-3-yl)ethylamino]-N,N-dipropylpyridine-3-carboxamide
CID 109237691
[5-[2-(1H-indol-3-yl)ethylamino]-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109225545
N-(3,5-dimethylphenyl)-2-[2-(1H-indol-3-yl)ethylamino]pyrimidine-5-carboxamide
CID 109261299
5-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]pyridine-3-carboxamide
CID 109237657
5-[2-(4-chlorophenyl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide
CID 109237845
N-(3,5-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109215354

Frequently Asked Questions

What is the IUPAC name of 5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide (CID 109237696) is 5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide is Cc1ccc(NC(=O)c2cncc(NCCc3c[nH]c4ccccc34)c2)cc1.
What is the InChIKey of 5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide?
The InChIKey is WPJLLKZGESOQQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O/c1-16-6-8-19(9-7-16)27-23(28)18-12-20(15-24-13-18)25-11-10-17-14-26-22-5-3-2-4-21(17)22/h2-9,12-15,25-26H,10-11H2,1H3,(H,27,28).
What are the key properties of 5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide?
5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide has a molecular weight of 370.46 g/mol, XLogP of 4.78, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(1H-indol-3-yl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109237696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).