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

C24H24N4O — CID 109215351

IUPACN-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc(NCCc3c[nH]c4ccccc34)ccn2)c(C)c1
InChIInChI=1S/C24H24N4O/c1-16-7-8-21(17(2)13-16)28-24(29)23-14-19(10-12-26-23)25-11-9-18-15-27-22-6-4-3-5-20(18)22/h3-8,10,12-15,27H,9,11H2,1-2H3,(H,25,26)(H,28,29)
InChIKeyXCWKNYGXESZHSN-UHFFFAOYSA-N
MW384.48 g/mol
LogP5.09
Rot. Bonds6

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

N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide (PubChem CID 109215351) has the molecular formula C24H24N4O and a molecular weight of 384.48 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
PubChem CID109215351
Molecular FormulaC24H24N4O
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC NameN-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc(NCCc3c[nH]c4ccccc34)ccn2)c(C)c1
InChIInChI=1S/C24H24N4O/c1-16-7-8-21(17(2)13-16)28-24(29)23-14-19(10-12-26-23)25-11-9-18-15-27-22-6-4-3-5-20(18)22/h3-8,10,12-15,27H,9,11H2,1-2H3,(H,25,26)(H,28,29)
InChIKeyXCWKNYGXESZHSN-UHFFFAOYSA-N
XLogP5.09
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.48
LogP ≤ 55.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109215354
N-cyclopentyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109204033
N-cyclohexyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109204779
N-(2,4-dimethylphenyl)-4-[(2-fluorophenyl)methylamino]pyridine-2-carboxamide
CID 109211300
N,N-diethyl-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide
CID 109215333
N-(2,4-dimethylphenyl)-3-[2-(1H-indol-3-yl)ethylamino]propanamide
CID 109027527
N-(2,5-dimethylphenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide
CID 109213674
4-[[(2R)-2-hydroxypropyl]amino]-N-[2-(1H-indol-3-yl)ethyl]pyridine-2-carboxamide
CID 95556692
6-(2,4-dimethylanilino)-N-[2-(1H-indol-3-yl)ethyl]pyrimidine-4-carboxamide
CID 109352254
4-(tert-butylamino)-N-[2-(1H-indol-3-yl)ethyl]pyridine-2-carboxamide
CID 109215296
3-(2,4-dimethylanilino)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 109027411
methyl 4-[4-[2-(1H-indol-3-yl)ethylamino]anilino]pyridine-2-carboxylate
CID 59555814

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
The IUPAC name of N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide (CID 109215351) is N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide is Cc1ccc(NC(=O)c2cc(NCCc3c[nH]c4ccccc34)ccn2)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
The InChIKey is XCWKNYGXESZHSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O/c1-16-7-8-21(17(2)13-16)28-24(29)23-14-19(10-12-26-23)25-11-9-18-15-27-22-6-4-3-5-20(18)22/h3-8,10,12-15,27H,9,11H2,1-2H3,(H,25,26)(H,28,29).
What are the key properties of N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide?
N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide has a molecular weight of 384.48 g/mol, XLogP of 5.09, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-4-[2-(1H-indol-3-yl)ethylamino]pyridine-2-carboxamide is sourced from PubChem (CID 109215351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).