5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide

C19H20N6O2 — CID 59587463

IUPAC5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide
SMILESNC(=O)c1nc(Nc2cccnc2)oc1-c1ccc(N2CCNCC2)cc1
InChIInChI=1S/C19H20N6O2/c20-18(26)16-17(27-19(24-16)23-14-2-1-7-22-12-14)13-3-5-15(6-4-13)25-10-8-21-9-11-25/h1-7,12,21H,8-11H2,(H2,20,26)(H,23,24)
InChIKeyDCQOAMZCSBFOKW-UHFFFAOYSA-N
MW364.41 g/mol
LogP1.99
Rot. Bonds5

About 5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide

5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide (PubChem CID 59587463) has the molecular formula C19H20N6O2 and a molecular weight of 364.41 g/mol. Its IUPAC name is 5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide
PubChem CID59587463
Molecular FormulaC19H20N6O2
Molecular Weight364.41 g/mol
Exact Mass364.16
IUPAC Name5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide
SMILESNC(=O)c1nc(Nc2cccnc2)oc1-c1ccc(N2CCNCC2)cc1
InChIInChI=1S/C19H20N6O2/c20-18(26)16-17(27-19(24-16)23-14-2-1-7-22-12-14)13-3-5-15(6-4-13)25-10-8-21-9-11-25/h1-7,12,21H,8-11H2,(H2,20,26)(H,23,24)
InChIKeyDCQOAMZCSBFOKW-UHFFFAOYSA-N
XLogP1.99
TPSA109.31 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

4-[4-[4-carbamoyl-2-(pyridin-3-ylamino)-1,3-oxazol-5-yl]phenyl]piperazine-1-carboxylic acid
CID 68633718
amino-[2-(3-methoxyanilino)-5-(4-piperazin-1-ylphenyl)-1,3-oxazol-4-yl]methanol
CID 90813547
2-(4-piperazin-1-ylanilino)pyrimidine-4-carboxamide
CID 69247814
2-(2,6-dimethylphenyl)-5-(4-piperazin-1-ylanilino)-1,3-oxazole-4-carboxamide
CID 59587513
5-(dimethylamino)-3-(4-piperazin-1-ylanilino)pyrazine-2-carboxamide
CID 167334977
2-(2,6-difluorophenyl)-5-(3-piperazin-1-ylanilino)-1,3-oxazole-4-carboxamide
CID 59587658
5-[[4-(piperazin-1-ylmethyl)benzoyl]amino]-2-(pyridin-3-ylamino)-1,3-thiazole-4-carboxamide;hydrochloride
CID 87521619
2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride
CID 156595313
N-(4-piperazin-1-ylphenyl)pyrimidin-2-amine
CID 82513989
4-(1,4-diazepan-1-yl)benzamide;hydrochloride
CID 68552362
2,4,6-tris(4-piperazin-1-ylphenyl)-1,3,5-triazine
CID 146566089
1-(3-pyridin-3-ylphenyl)piperazine
CID 150431219

Frequently Asked Questions

What is the IUPAC name of 5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide (CID 59587463) is 5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide is NC(=O)c1nc(Nc2cccnc2)oc1-c1ccc(N2CCNCC2)cc1.
What is the InChIKey of 5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide?
The InChIKey is DCQOAMZCSBFOKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O2/c20-18(26)16-17(27-19(24-16)23-14-2-1-7-22-12-14)13-3-5-15(6-4-13)25-10-8-21-9-11-25/h1-7,12,21H,8-11H2,(H2,20,26)(H,23,24).
What are the key properties of 5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide?
5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide has a molecular weight of 364.41 g/mol, XLogP of 1.99, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-piperazin-1-ylphenyl)-2-(pyridin-3-ylamino)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 59587463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).