2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide

C21H28N4O2 — CID 109168022

IUPAC2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
SMILESCCN(c1cccc(C)c1)c1cc(C(=O)NCCN2CCOCC2)ccn1
InChIInChI=1S/C21H28N4O2/c1-3-25(19-6-4-5-17(2)15-19)20-16-18(7-8-22-20)21(26)23-9-10-24-11-13-27-14-12-24/h4-8,15-16H,3,9-14H2,1-2H3,(H,23,26)
InChIKeyDUIGRLCHDHHHSB-UHFFFAOYSA-N
MW368.48 g/mol
LogP2.61
Rot. Bonds7

About 2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide

2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide (PubChem CID 109168022) has the molecular formula C21H28N4O2 and a molecular weight of 368.48 g/mol. Its IUPAC name is 2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
PubChem CID109168022
Molecular FormulaC21H28N4O2
Molecular Weight368.48 g/mol
Exact Mass368.22
IUPAC Name2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
SMILESCCN(c1cccc(C)c1)c1cc(C(=O)NCCN2CCOCC2)ccn1
InChIInChI=1S/C21H28N4O2/c1-3-25(19-6-4-5-17(2)15-19)20-16-18(7-8-22-20)21(26)23-9-10-24-11-13-27-14-12-24/h4-8,15-16H,3,9-14H2,1-2H3,(H,23,26)
InChIKeyDUIGRLCHDHHHSB-UHFFFAOYSA-N
XLogP2.61
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 84580344
2-N-(2,6-dimethylphenyl)-4-N-(2-morpholin-4-ylethyl)pyridine-2,4-dicarboxamide
CID 109083750
6-(N-ethylanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115714
N'-ethyl-N'-(3-methylphenyl)-N-(2-morpholin-4-ylethyl)propanediamide
CID 108944137
N-(2-morpholin-4-ylethyl)-2-(2,4,6-trimethylanilino)pyridine-4-carboxamide
CID 109167966
2-N-(2,5-dimethylphenyl)-4-N-(2-morpholin-4-ylethyl)pyridine-2,4-dicarboxamide
CID 109083747
6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide
CID 142825868
2-(2,3-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109167959
2,3-dihydroindol-1-yl-[2-(N-ethyl-3-methylanilino)-4-pyridinyl]methanone
CID 109176460
3-bromo-N-(2-morpholin-4-ylethyl)benzamide
CID 669309
4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-ylpyridine-2,4-dicarboxamide
CID 109078221
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484

Frequently Asked Questions

What is the IUPAC name of 2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The IUPAC name of 2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide (CID 109168022) is 2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide is CCN(c1cccc(C)c1)c1cc(C(=O)NCCN2CCOCC2)ccn1.
What is the InChIKey of 2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The InChIKey is DUIGRLCHDHHHSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N4O2/c1-3-25(19-6-4-5-17(2)15-19)20-16-18(7-8-22-20)21(26)23-9-10-24-11-13-27-14-12-24/h4-8,15-16H,3,9-14H2,1-2H3,(H,23,26).
What are the key properties of 2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide has a molecular weight of 368.48 g/mol, XLogP of 2.61, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-ethyl-3-methylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 109168022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).