2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide

C22H29N5O2 — CID 109168802

IUPAC2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide
SMILESCCN1CCN(c2cc(C(=O)Nc3ccccc3N3CCOCC3)ccn2)CC1
InChIInChI=1S/C22H29N5O2/c1-2-25-9-11-27(12-10-25)21-17-18(7-8-23-21)22(28)24-19-5-3-4-6-20(19)26-13-15-29-16-14-26/h3-8,17H,2,9-16H2,1H3,(H,24,28)
InChIKeyTWCOPINWLVWQAX-UHFFFAOYSA-N
MW395.51 g/mol
LogP2.31
Rot. Bonds5

About 2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide

2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide (PubChem CID 109168802) has the molecular formula C22H29N5O2 and a molecular weight of 395.51 g/mol. Its IUPAC name is 2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide
PubChem CID109168802
Molecular FormulaC22H29N5O2
Molecular Weight395.51 g/mol
Exact Mass395.23
IUPAC Name2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide
SMILESCCN1CCN(c2cc(C(=O)Nc3ccccc3N3CCOCC3)ccn2)CC1
InChIInChI=1S/C22H29N5O2/c1-2-25-9-11-27(12-10-25)21-17-18(7-8-23-21)22(28)24-19-5-3-4-6-20(19)26-13-15-29-16-14-26/h3-8,17H,2,9-16H2,1H3,(H,24,28)
InChIKeyTWCOPINWLVWQAX-UHFFFAOYSA-N
XLogP2.31
TPSA60.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.51
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide
CID 109175707
ethyl 2-[[2-(4-ethylpiperazin-1-yl)pyridine-4-carbonyl]amino]benzoate
CID 109168819
N-(2-morpholin-4-ylphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 109004729
2-(2-methoxyethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide
CID 109166957
N-[2-(4-ethylpiperazin-1-yl)phenyl]-3-iodobenzamide
CID 18190160
N-[2-(4-ethylpiperazin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide
CID 46534125
N-(2,3-dichlorophenyl)-2-morpholin-4-ylpyridine-4-carboxamide
CID 109167430
N-(4-chloro-2-methylphenyl)-2-(4-ethylpiperazin-1-yl)pyridine-4-carboxamide
CID 109168773
4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide
CID 109088856
2-(4-ethylpiperazin-1-yl)-N-(4-pyrrolidin-1-ylphenyl)pyridine-4-carboxamide
CID 109168800
2-N-cyclopropyl-4-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide
CID 109078752
2-(4-methylpiperazin-1-yl)-N-[2-(5-methylpyrazol-1-yl)phenyl]pyridine-4-carboxamide
CID 126780133

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide (CID 109168802) is 2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide is CCN1CCN(c2cc(C(=O)Nc3ccccc3N3CCOCC3)ccn2)CC1.
What is the InChIKey of 2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide?
The InChIKey is TWCOPINWLVWQAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N5O2/c1-2-25-9-11-27(12-10-25)21-17-18(7-8-23-21)22(28)24-19-5-3-4-6-20(19)26-13-15-29-16-14-26/h3-8,17H,2,9-16H2,1H3,(H,24,28).
What are the key properties of 2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide?
2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide has a molecular weight of 395.51 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109168802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).