5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide

C20H26N4O2 — CID 109229512

IUPAC5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
SMILESCc1ccc(Nc2cncc(C(=O)NCCN3CCOCC3)c2)cc1C
InChIInChI=1S/C20H26N4O2/c1-15-3-4-18(11-16(15)2)23-19-12-17(13-21-14-19)20(25)22-5-6-24-7-9-26-10-8-24/h3-4,11-14,23H,5-10H2,1-2H3,(H,22,25)
InChIKeyJAUAVAJMZWFFEM-UHFFFAOYSA-N
MW354.45 g/mol
LogP2.50
Rot. Bonds6

About 5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide

5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide (PubChem CID 109229512) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is 5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
PubChem CID109229512
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC Name5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
SMILESCc1ccc(Nc2cncc(C(=O)NCCN3CCOCC3)c2)cc1C
InChIInChI=1S/C20H26N4O2/c1-15-3-4-18(11-16(15)2)23-19-12-17(13-21-14-19)20(25)22-5-6-24-7-9-26-10-8-24/h3-4,11-14,23H,5-10H2,1-2H3,(H,22,25)
InChIKeyJAUAVAJMZWFFEM-UHFFFAOYSA-N
XLogP2.50
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-N-(3,4-dimethylphenyl)-3-N-(2-morpholin-4-ylethyl)pyridine-3,5-dicarboxamide
CID 109104222
2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109167956
N-(2-morpholin-4-ylethyl)-5-[2-(trifluoromethyl)anilino]pyridine-3-carboxamide
CID 109229551
5-[2-(2-methoxyphenyl)ethylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 109229476
4-[(3,4-dimethylphenyl)sulfamoyl]-N-(2-morpholin-4-ylethyl)benzamide
CID 22108828
5-(3,4-dimethylanilino)-N-(3,4-dimethylphenyl)pyridine-3-carboxamide
CID 109242892
N-[3-(dimethylamino)propyl]-5-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 109229586
5-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 117088063
N-(4-tert-butylphenyl)-5-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 109229662
5-N-cyclopentyl-3-N-(2-morpholin-4-ylethyl)pyridine-3,5-dicarboxamide
CID 109102673
5-N-(3-methoxyphenyl)-3-N-(2-morpholin-4-ylethyl)pyridine-3,5-dicarboxamide
CID 109104239
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484

Frequently Asked Questions

What is the IUPAC name of 5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
The IUPAC name of 5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide (CID 109229512) is 5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide is Cc1ccc(Nc2cncc(C(=O)NCCN3CCOCC3)c2)cc1C.
What is the InChIKey of 5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
The InChIKey is JAUAVAJMZWFFEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-15-3-4-18(11-16(15)2)23-19-12-17(13-21-14-19)20(25)22-5-6-24-7-9-26-10-8-24/h3-4,11-14,23H,5-10H2,1-2H3,(H,22,25).
What are the key properties of 5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide?
5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide has a molecular weight of 354.45 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 109229512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).