N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide

C15H15N5O2 — CID 57450323

IUPACN-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide
SMILESCc1noc(C)c1Cn1cc(NC(=O)c2ccncc2)cn1
InChIInChI=1S/C15H15N5O2/c1-10-14(11(2)22-19-10)9-20-8-13(7-17-20)18-15(21)12-3-5-16-6-4-12/h3-8H,9H2,1-2H3,(H,18,21)
InChIKeyMJVXCGOCXOWTTG-UHFFFAOYSA-N
MW297.32 g/mol
LogP2.18
Rot. Bonds4

About N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide

N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide (PubChem CID 57450323) has the molecular formula C15H15N5O2 and a molecular weight of 297.32 g/mol. Its IUPAC name is N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide
PubChem CID57450323
Molecular FormulaC15H15N5O2
Molecular Weight297.32 g/mol
Exact Mass297.12
IUPAC NameN-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide
SMILESCc1noc(C)c1Cn1cc(NC(=O)c2ccncc2)cn1
InChIInChI=1S/C15H15N5O2/c1-10-14(11(2)22-19-10)9-20-8-13(7-17-20)18-15(21)12-3-5-16-6-4-12/h3-8H,9H2,1-2H3,(H,18,21)
InChIKeyMJVXCGOCXOWTTG-UHFFFAOYSA-N
XLogP2.18
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide?
The IUPAC name of N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide (CID 57450323) is N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide.
What is the SMILES notation for N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide?
The canonical SMILES for N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide is Cc1noc(C)c1Cn1cc(NC(=O)c2ccncc2)cn1.
What is the InChIKey of N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide?
The InChIKey is MJVXCGOCXOWTTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2/c1-10-14(11(2)22-19-10)9-20-8-13(7-17-20)18-15(21)12-3-5-16-6-4-12/h3-8H,9H2,1-2H3,(H,18,21).
What are the key properties of N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide?
N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide has a molecular weight of 297.32 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]pyridine-4-carboxamide is sourced from PubChem (CID 57450323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).