2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide

C19H27N5O4 — CID 109083708

IUPAC2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
SMILESCC(=O)N1CCN(C(=O)c2cc(C(=O)NCCN3CCOCC3)ccn2)CC1
InChIInChI=1S/C19H27N5O4/c1-15(25)23-6-8-24(9-7-23)19(27)17-14-16(2-3-20-17)18(26)21-4-5-22-10-12-28-13-11-22/h2-3,14H,4-13H2,1H3,(H,21,26)
InChIKeyXKWDKUYXPKMEDA-UHFFFAOYSA-N
MW389.46 g/mol
LogP-0.55
Rot. Bonds5

About 2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide

2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide (PubChem CID 109083708) has the molecular formula C19H27N5O4 and a molecular weight of 389.46 g/mol. Its IUPAC name is 2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
PubChem CID109083708
Molecular FormulaC19H27N5O4
Molecular Weight389.46 g/mol
Exact Mass389.21
IUPAC Name2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
SMILESCC(=O)N1CCN(C(=O)c2cc(C(=O)NCCN3CCOCC3)ccn2)CC1
InChIInChI=1S/C19H27N5O4/c1-15(25)23-6-8-24(9-7-23)19(27)17-14-16(2-3-20-17)18(26)21-4-5-22-10-12-28-13-11-22/h2-3,14H,4-13H2,1H3,(H,21,26)
InChIKeyXKWDKUYXPKMEDA-UHFFFAOYSA-N
XLogP-0.55
TPSA95.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-N-(2-morpholin-4-ylethyl)-2-N-propan-2-ylpyridine-2,4-dicarboxamide
CID 109078221
2-N-(3-methylbutyl)-4-N-(2-morpholin-4-ylethyl)pyridine-2,4-dicarboxamide
CID 109083732
N-(2-methylpropyl)-2-(morpholine-4-carbonyl)pyridine-4-carboxamide
CID 109079570
N-(3-methylbutyl)-2-(morpholine-4-carbonyl)pyridine-4-carboxamide
CID 109083009
4-N-(3-methoxypropyl)-2-N-(2-morpholin-4-ylethyl)pyridine-2,4-dicarboxamide
CID 109082488
2-N-(2,6-dimethylphenyl)-4-N-(2-morpholin-4-ylethyl)pyridine-2,4-dicarboxamide
CID 109083750
4-N-cyclopropyl-2-N-(2-morpholin-4-ylethyl)pyridine-2,4-dicarboxamide
CID 109078417
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-(4-ethylpiperazine-1-carbonyl)-N-propylpyridine-4-carboxamide
CID 109077634
N-(2-morpholin-4-ylethyl)-2-(2,4,6-trimethylanilino)pyridine-4-carboxamide
CID 109167966
4-amino-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 62156261

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The IUPAC name of 2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide (CID 109083708) is 2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide is CC(=O)N1CCN(C(=O)c2cc(C(=O)NCCN3CCOCC3)ccn2)CC1.
What is the InChIKey of 2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
The InChIKey is XKWDKUYXPKMEDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O4/c1-15(25)23-6-8-24(9-7-23)19(27)17-14-16(2-3-20-17)18(26)21-4-5-22-10-12-28-13-11-22/h2-3,14H,4-13H2,1H3,(H,21,26).
What are the key properties of 2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide?
2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide has a molecular weight of 389.46 g/mol, XLogP of -0.55, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylpiperazine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 109083708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).