N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide

C13H15N5O2 — CID 119494181

IUPACN-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1ccc(N2CCNCC2)cn1)c1ccon1
InChIInChI=1S/C13H15N5O2/c19-13(11-3-8-20-17-11)16-12-2-1-10(9-15-12)18-6-4-14-5-7-18/h1-3,8-9,14H,4-7H2,(H,15,16,19)
InChIKeyLTCHSZQQHDXKJC-UHFFFAOYSA-N
MW273.30 g/mol
LogP0.73
Rot. Bonds3

About N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide

N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide (PubChem CID 119494181) has the molecular formula C13H15N5O2 and a molecular weight of 273.30 g/mol. Its IUPAC name is N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide
PubChem CID119494181
Molecular FormulaC13H15N5O2
Molecular Weight273.30 g/mol
Exact Mass273.12
IUPAC NameN-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1ccc(N2CCNCC2)cn1)c1ccon1
InChIInChI=1S/C13H15N5O2/c19-13(11-3-8-20-17-11)16-12-2-1-10(9-15-12)18-6-4-14-5-7-18/h1-3,8-9,14H,4-7H2,(H,15,16,19)
InChIKeyLTCHSZQQHDXKJC-UHFFFAOYSA-N
XLogP0.73
TPSA83.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-chloro-N-(5-piperazin-1-yl-2-pyridinyl)benzamide;hydrochloride
CID 119494622
3,4-dichloro-N-(5-piperazin-1-yl-2-pyridinyl)benzamide
CID 119494091
5-methyl-N-(5-piperazin-1-yl-2-pyridinyl)furan-2-carboxamide
CID 119494477
6-methyl-N-(5-piperazin-1-yl-2-pyridinyl)pyridine-3-carboxamide;dihydrochloride
CID 119494408
2,4-dimethyl-N-(5-piperazin-1-yl-2-pyridinyl)-1,3-oxazole-5-carboxamide;hydrochloride
CID 119494520
N-(5-piperazin-1-yl-2-pyridinyl)-4-(trifluoromethyl)benzamide;hydrochloride
CID 119494136
2-cyclopentyl-N-(5-piperazin-1-yl-2-pyridinyl)acetamide
CID 119260362
N-(5-piperazin-1-yl-2-pyridinyl)-1-sulfamoylazetidine-3-carboxamide
CID 166394145
3-fluoro-N-(5-piperazin-1-yl-2-pyridinyl)benzamide
CID 119494063
2-oxo-N-(5-piperazin-1-yl-2-pyridinyl)-1H-pyridine-4-carboxamide;hydrochloride
CID 119494214
N-(5-piperazin-1-yl-2-pyridinyl)-4-propan-2-ylbenzamide;hydrochloride
CID 119494632
N-(5-piperazin-1-yl-2-pyridinyl)-1,3-benzodioxole-5-carboxamide;hydrochloride
CID 119494454

Frequently Asked Questions

What is the IUPAC name of N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide (CID 119494181) is N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide is O=C(Nc1ccc(N2CCNCC2)cn1)c1ccon1.
What is the InChIKey of N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide?
The InChIKey is LTCHSZQQHDXKJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O2/c19-13(11-3-8-20-17-11)16-12-2-1-10(9-15-12)18-6-4-14-5-7-18/h1-3,8-9,14H,4-7H2,(H,15,16,19).
What are the key properties of N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide?
N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide has a molecular weight of 273.30 g/mol, XLogP of 0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-piperazin-1-yl-2-pyridinyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 119494181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).