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

C20H26N4O2 — CID 109167956

IUPAC2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
SMILESCc1ccc(Nc2cc(C(=O)NCCN3CCOCC3)ccn2)cc1C
InChIInChI=1S/C20H26N4O2/c1-15-3-4-18(13-16(15)2)23-19-14-17(5-6-21-19)20(25)22-7-8-24-9-11-26-12-10-24/h3-6,13-14H,7-12H2,1-2H3,(H,21,23)(H,22,25)
InChIKeyCASIJXXRUUKKTR-UHFFFAOYSA-N
MW354.45 g/mol
LogP2.50
Rot. Bonds6

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

2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide (PubChem CID 109167956) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is 2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
PubChem CID109167956
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC Name2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
SMILESCc1ccc(Nc2cc(C(=O)NCCN3CCOCC3)ccn2)cc1C
InChIInChI=1S/C20H26N4O2/c1-15-3-4-18(13-16(15)2)23-19-14-17(5-6-21-19)20(25)22-7-8-24-9-11-26-12-10-24/h3-6,13-14H,7-12H2,1-2H3,(H,21,23)(H,22,25)
InChIKeyCASIJXXRUUKKTR-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

N-(2-morpholin-4-ylethyl)-2-(2,4,6-trimethylanilino)pyridine-4-carboxamide
CID 109167966
2-(1,3-benzodioxol-5-ylamino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109168006
2-(2,3-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109167959
5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 109229512
2-(2,4-dimethoxyanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109167991
2-(2-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109168019
5-N-(3,4-dimethylphenyl)-3-N-(2-morpholin-4-ylethyl)pyridine-3,5-dicarboxamide
CID 109104222
2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109167907
2-(3,4-dimethylanilino)-N-(3-methoxypropyl)pyridine-4-carboxamide
CID 109167052
2-methoxy-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 84580344
2-N-(2,5-dimethylphenyl)-4-N-(2-morpholin-4-ylethyl)pyridine-2,4-dicarboxamide
CID 109083747
2-N-(2,6-dimethylphenyl)-4-N-(2-morpholin-4-ylethyl)pyridine-2,4-dicarboxamide
CID 109083750

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The IUPAC name of 2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide (CID 109167956) is 2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide is Cc1ccc(Nc2cc(C(=O)NCCN3CCOCC3)ccn2)cc1C.
What is the InChIKey of 2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The InChIKey is CASIJXXRUUKKTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-15-3-4-18(13-16(15)2)23-19-14-17(5-6-21-19)20(25)22-7-8-24-9-11-26-12-10-24/h3-6,13-14H,7-12H2,1-2H3,(H,21,23)(H,22,25).
What are the key properties of 2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-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 2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 109167956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).