2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide

C22H23N5O2 — CID 109084621

IUPAC2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide
SMILESCCN1CCN(C(=O)c2cc(C(=O)Nc3cccc4cccnc34)ccn2)CC1
InChIInChI=1S/C22H23N5O2/c1-2-26-11-13-27(14-12-26)22(29)19-15-17(8-10-23-19)21(28)25-18-7-3-5-16-6-4-9-24-20(16)18/h3-10,15H,2,11-14H2,1H3,(H,25,28)
InChIKeyKSWUSSSUXLFATQ-UHFFFAOYSA-N
MW389.46 g/mol
LogP2.66
Rot. Bonds4

About 2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide

2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide (PubChem CID 109084621) has the molecular formula C22H23N5O2 and a molecular weight of 389.46 g/mol. Its IUPAC name is 2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide
PubChem CID109084621
Molecular FormulaC22H23N5O2
Molecular Weight389.46 g/mol
Exact Mass389.19
IUPAC Name2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide
SMILESCCN1CCN(C(=O)c2cc(C(=O)Nc3cccc4cccnc34)ccn2)CC1
InChIInChI=1S/C22H23N5O2/c1-2-26-11-13-27(14-12-26)22(29)19-15-17(8-10-23-19)21(28)25-18-7-3-5-16-6-4-9-24-20(16)18/h3-10,15H,2,11-14H2,1H3,(H,25,28)
InChIKeyKSWUSSSUXLFATQ-UHFFFAOYSA-N
XLogP2.66
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109104633
2-(4-ethylpiperazine-1-carbonyl)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 109084601
N-(3-chloro-2-methylphenyl)-4-(4-ethylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109084484
5-(4-ethylpiperazin-1-yl)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109230694
N-tert-butyl-2-(4-ethylpiperazine-1-carbonyl)pyridine-4-carboxamide
CID 109084555
2-(4-ethylpiperazine-1-carbonyl)-N-propylpyridine-4-carboxamide
CID 109077634
3-(4-formylpiperazine-1-carbonyl)-N-quinolin-8-ylbenzamide
CID 109053846
2-(4-ethylpiperazine-1-carbonyl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-4-carboxamide
CID 109084586
[2-(4-ethylpiperazine-1-carbonyl)-4-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109084137
2-(4-ethylpiperazine-1-carbonyl)-N-[(3-methylphenyl)methyl]pyridine-4-carboxamide
CID 109084527
4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide
CID 109084455
2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide
CID 109091249

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide?
The IUPAC name of 2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide (CID 109084621) is 2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide.
What is the SMILES notation for 2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide?
The canonical SMILES for 2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide is CCN1CCN(C(=O)c2cc(C(=O)Nc3cccc4cccnc34)ccn2)CC1.
What is the InChIKey of 2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide?
The InChIKey is KSWUSSSUXLFATQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O2/c1-2-26-11-13-27(14-12-26)22(29)19-15-17(8-10-23-19)21(28)25-18-7-3-5-16-6-4-9-24-20(16)18/h3-10,15H,2,11-14H2,1H3,(H,25,28).
What are the key properties of 2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide?
2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylpiperazine-1-carbonyl)-N-quinolin-8-ylpyridine-4-carboxamide is sourced from PubChem (CID 109084621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).