N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide

C22H19N3O2 — CID 68637316

IUPACN-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide
SMILESCc1ccc(Oc2ccc(C(=O)NCc3ccc4[nH]ccc4c3)nc2)cc1
InChIInChI=1S/C22H19N3O2/c1-15-2-5-18(6-3-15)27-19-7-9-21(24-14-19)22(26)25-13-16-4-8-20-17(12-16)10-11-23-20/h2-12,14,23H,13H2,1H3,(H,25,26)
InChIKeyUTYWFGWUHWXEHD-UHFFFAOYSA-N
MW357.41 g/mol
LogP4.59
Rot. Bonds5

About N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide

N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide (PubChem CID 68637316) has the molecular formula C22H19N3O2 and a molecular weight of 357.41 g/mol. Its IUPAC name is N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide
PubChem CID68637316
Molecular FormulaC22H19N3O2
Molecular Weight357.41 g/mol
Exact Mass357.15
IUPAC NameN-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide
SMILESCc1ccc(Oc2ccc(C(=O)NCc3ccc4[nH]ccc4c3)nc2)cc1
InChIInChI=1S/C22H19N3O2/c1-15-2-5-18(6-3-15)27-19-7-9-21(24-14-19)22(26)25-13-16-4-8-20-17(12-16)10-11-23-20/h2-12,14,23H,13H2,1H3,(H,25,26)
InChIKeyUTYWFGWUHWXEHD-UHFFFAOYSA-N
XLogP4.59
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-ethoxy-N-(1H-indol-5-ylmethyl)pyridine-3-carboxamide
CID 68629889
ethyl N-(1H-indol-5-ylmethyl)carbamate
CID 59248610
N-(1H-indol-5-ylmethyl)-4-(trifluoromethoxy)benzamide
CID 68637610
methyl 5-(4-methylphenoxy)pyridine-2-carboxylate
CID 59966219
N-[(4-methoxyphenyl)methyl]-5-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190354
5-amino-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 81320128
5-(4-methylanilino)-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide
CID 109188420
4-[(1H-indole-5-carbonylamino)methyl]benzoic acid
CID 141342691
4-[[[5-(1H-indol-5-yl)-1-methylpyrazole-3-carbonyl]amino]methyl]benzoic acid
CID 56850410
5-methyl-N-[[4-(4-methylphenoxy)phenyl]methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide
CID 46978339
N-[(3-chloro-4-fluorophenyl)methyl]-1H-indole-5-carboxamide
CID 63718652
5-(2,5-dimethylanilino)-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide
CID 109188662

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide?
The IUPAC name of N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide (CID 68637316) is N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide.
What is the SMILES notation for N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide?
The canonical SMILES for N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide is Cc1ccc(Oc2ccc(C(=O)NCc3ccc4[nH]ccc4c3)nc2)cc1.
What is the InChIKey of N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide?
The InChIKey is UTYWFGWUHWXEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2/c1-15-2-5-18(6-3-15)27-19-7-9-21(24-14-19)22(26)25-13-16-4-8-20-17(12-16)10-11-23-20/h2-12,14,23H,13H2,1H3,(H,25,26).
What are the key properties of N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide?
N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide has a molecular weight of 357.41 g/mol, XLogP of 4.59, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-5-ylmethyl)-5-(4-methylphenoxy)pyridine-2-carboxamide is sourced from PubChem (CID 68637316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).