4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide

C19H22N4O2 — CID 109084455

IUPAC4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide
SMILESCCN1CCN(C(=O)c2ccnc(C(=O)Nc3ccccc3)c2)CC1
InChIInChI=1S/C19H22N4O2/c1-2-22-10-12-23(13-11-22)19(25)15-8-9-20-17(14-15)18(24)21-16-6-4-3-5-7-16/h3-9,14H,2,10-13H2,1H3,(H,21,24)
InChIKeySXMXAOPRAKCZOG-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.11
Rot. Bonds4

About 4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide

4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide (PubChem CID 109084455) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is 4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide
PubChem CID109084455
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide
SMILESCCN1CCN(C(=O)c2ccnc(C(=O)Nc3ccccc3)c2)CC1
InChIInChI=1S/C19H22N4O2/c1-2-22-10-12-23(13-11-22)19(25)15-8-9-20-17(14-15)18(24)21-16-6-4-3-5-7-16/h3-9,14H,2,10-13H2,1H3,(H,21,24)
InChIKeySXMXAOPRAKCZOG-UHFFFAOYSA-N
XLogP2.11
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-ethoxyphenyl)-4-(4-ethylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109084493
N-phenyl-4-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109081096
N-(3-chloro-2-methylphenyl)-4-(4-ethylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109084484
4-(4-ethylpiperazine-1-carbonyl)-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 109084444
2-(4-ethylpiperazine-1-carbonyl)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 109084601
4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 109084521
4-(4-acetylpiperazine-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide
CID 109084898
[2-(4-ethylpiperazine-1-carbonyl)-4-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109084137
4-(4-benzylpiperazine-1-carbonyl)-N-propan-2-ylpyridine-2-carboxamide
CID 109078255
2-(4-ethylpiperazine-1-carbonyl)-N-propylpyridine-4-carboxamide
CID 109077634
N-tert-butyl-2-(4-ethylpiperazine-1-carbonyl)pyridine-4-carboxamide
CID 109084555
[2-(4-ethylpiperazine-1-carbonyl)-4-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 109081659

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide?
The IUPAC name of 4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide (CID 109084455) is 4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide.
What is the SMILES notation for 4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide?
The canonical SMILES for 4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide is CCN1CCN(C(=O)c2ccnc(C(=O)Nc3ccccc3)c2)CC1.
What is the InChIKey of 4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide?
The InChIKey is SXMXAOPRAKCZOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-2-22-10-12-23(13-11-22)19(25)15-8-9-20-17(14-15)18(24)21-16-6-4-3-5-7-16/h3-9,14H,2,10-13H2,1H3,(H,21,24).
What are the key properties of 4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide?
4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide is sourced from PubChem (CID 109084455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).