N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide

C19H17N7O2 — CID 69284179

IUPACN-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide
SMILESCc1cc(C)n(-c2cc(NC(=O)Cc3cccnc3)nc(-c3ncco3)n2)n1
InChIInChI=1S/C19H17N7O2/c1-12-8-13(2)26(25-12)16-10-15(23-18(24-16)19-21-6-7-28-19)22-17(27)9-14-4-3-5-20-11-14/h3-8,10-11H,9H2,1-2H3,(H,22,23,24,27)
InChIKeyPQWLIFZUYFEPRF-UHFFFAOYSA-N
MW375.39 g/mol
LogP2.51
Rot. Bonds5

About N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide

N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide (PubChem CID 69284179) has the molecular formula C19H17N7O2 and a molecular weight of 375.39 g/mol. Its IUPAC name is N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide
PubChem CID69284179
Molecular FormulaC19H17N7O2
Molecular Weight375.39 g/mol
Exact Mass375.14
IUPAC NameN-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide
SMILESCc1cc(C)n(-c2cc(NC(=O)Cc3cccnc3)nc(-c3ncco3)n2)n1
InChIInChI=1S/C19H17N7O2/c1-12-8-13(2)26(25-12)16-10-15(23-18(24-16)19-21-6-7-28-19)22-17(27)9-14-4-3-5-20-11-14/h3-8,10-11H,9H2,1-2H3,(H,22,23,24,27)
InChIKeyPQWLIFZUYFEPRF-UHFFFAOYSA-N
XLogP2.51
TPSA111.62 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.39
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide?
The IUPAC name of N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide (CID 69284179) is N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide?
The canonical SMILES for N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide is Cc1cc(C)n(-c2cc(NC(=O)Cc3cccnc3)nc(-c3ncco3)n2)n1.
What is the InChIKey of N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide?
The InChIKey is PQWLIFZUYFEPRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N7O2/c1-12-8-13(2)26(25-12)16-10-15(23-18(24-16)19-21-6-7-28-19)22-17(27)9-14-4-3-5-20-11-14/h3-8,10-11H,9H2,1-2H3,(H,22,23,24,27).
What are the key properties of N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide?
N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide has a molecular weight of 375.39 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3,5-dimethylpyrazol-1-yl)-2-(1,3-oxazol-2-yl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 69284179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).