4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide

C17H21N5O3 — CID 109084521

IUPAC4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
SMILESCCN1CCN(C(=O)c2ccnc(C(=O)Nc3cc(C)on3)c2)CC1
InChIInChI=1S/C17H21N5O3/c1-3-21-6-8-22(9-7-21)17(24)13-4-5-18-14(11-13)16(23)19-15-10-12(2)25-20-15/h4-5,10-11H,3,6-9H2,1-2H3,(H,19,20,23)
InChIKeyOPLQNPQDEIWJOK-UHFFFAOYSA-N
MW343.39 g/mol
LogP1.41
Rot. Bonds4

About 4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide

4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide (PubChem CID 109084521) has the molecular formula C17H21N5O3 and a molecular weight of 343.39 g/mol. Its IUPAC name is 4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
PubChem CID109084521
Molecular FormulaC17H21N5O3
Molecular Weight343.39 g/mol
Exact Mass343.16
IUPAC Name4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
SMILESCCN1CCN(C(=O)c2ccnc(C(=O)Nc3cc(C)on3)c2)CC1
InChIInChI=1S/C17H21N5O3/c1-3-21-6-8-22(9-7-21)17(24)13-4-5-18-14(11-13)16(23)19-15-10-12(2)25-20-15/h4-5,10-11H,3,6-9H2,1-2H3,(H,19,20,23)
InChIKeyOPLQNPQDEIWJOK-UHFFFAOYSA-N
XLogP1.41
TPSA91.57 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(5-methyl-1,2-oxazol-3-yl)-4-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109080499
N-(5-methyl-1,2-oxazol-3-yl)-2-(4-methylpiperazine-1-carbonyl)pyridine-4-carboxamide
CID 109084410
4-(4-ethylpiperazine-1-carbonyl)-N-phenylpyridine-2-carboxamide
CID 109084455
N-(4-ethoxyphenyl)-4-(4-ethylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109084493
N-(3-chloro-2-methylphenyl)-4-(4-ethylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109084484
6-(4-ethylpiperazin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4-carboxamide
CID 109345399
[2-(4-ethylpiperazine-1-carbonyl)-4-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109084137
4-N-cyclopentyl-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
CID 109080854
4-N-(4-acetamidophenyl)-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
CID 109093229
2-(4-ethylpiperazine-1-carbonyl)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 109084601
2-(4-benzoylpiperazin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 9223107
N-tert-butyl-2-(4-ethylpiperazine-1-carbonyl)pyridine-4-carboxamide
CID 109084555

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide?
The IUPAC name of 4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide (CID 109084521) is 4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide is CCN1CCN(C(=O)c2ccnc(C(=O)Nc3cc(C)on3)c2)CC1.
What is the InChIKey of 4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide?
The InChIKey is OPLQNPQDEIWJOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O3/c1-3-21-6-8-22(9-7-21)17(24)13-4-5-18-14(11-13)16(23)19-15-10-12(2)25-20-15/h4-5,10-11H,3,6-9H2,1-2H3,(H,19,20,23).
What are the key properties of 4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide?
4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide has a molecular weight of 343.39 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethylpiperazine-1-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 109084521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).