5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide

C19H17N7O2 — CID 122300733

IUPAC5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide
SMILESCc1nn(-c2ncc(NC(=O)c3cc(-c4cccnc4)on3)cn2)c(C)c1C
InChIInChI=1S/C19H17N7O2/c1-11-12(2)24-26(13(11)3)19-21-9-15(10-22-19)23-18(27)16-7-17(28-25-16)14-5-4-6-20-8-14/h4-10H,1-3H3,(H,23,27)
InChIKeyVKTMZNKMOBNURF-UHFFFAOYSA-N
MW375.39 g/mol
LogP2.89
Rot. Bonds4

About 5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide

5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide (PubChem CID 122300733) has the molecular formula C19H17N7O2 and a molecular weight of 375.39 g/mol. Its IUPAC name is 5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide
PubChem CID122300733
Molecular FormulaC19H17N7O2
Molecular Weight375.39 g/mol
Exact Mass375.14
IUPAC Name5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide
SMILESCc1nn(-c2ncc(NC(=O)c3cc(-c4cccnc4)on3)cn2)c(C)c1C
InChIInChI=1S/C19H17N7O2/c1-11-12(2)24-26(13(11)3)19-21-9-15(10-22-19)23-18(27)16-7-17(28-25-16)14-5-4-6-20-8-14/h4-10H,1-3H3,(H,23,27)
InChIKeyVKTMZNKMOBNURF-UHFFFAOYSA-N
XLogP2.89
TPSA111.62 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.39
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

5-pyridin-3-yl-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide
CID 122301419
N-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 86843516
N-(2-methylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 52986112
N-(4-anilinophenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 47048043
3-phenyl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-2,1-benzoxazole-5-carboxamide
CID 122300728
N-[3-(dimethylamino)-4-methylphenyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 53051794
N-(2-chloro-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 17253103
N-[3-methyl-5-(trifluoromethyl)phenyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 119049246
N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 122302827
2,6-difluoro-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]benzamide
CID 71789825
N-(2-methyl-1,3-benzoxazol-5-yl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 46491961
N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 139005695

Frequently Asked Questions

What is the IUPAC name of 5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide (CID 122300733) is 5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide is Cc1nn(-c2ncc(NC(=O)c3cc(-c4cccnc4)on3)cn2)c(C)c1C.
What is the InChIKey of 5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide?
The InChIKey is VKTMZNKMOBNURF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N7O2/c1-11-12(2)24-26(13(11)3)19-21-9-15(10-22-19)23-18(27)16-7-17(28-25-16)14-5-4-6-20-8-14/h4-10H,1-3H3,(H,23,27).
What are the key properties of 5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide?
5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide has a molecular weight of 375.39 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-3-yl-N-[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 122300733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).