N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide

C17H14N4O2 — CID 46880470

IUPACN-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(-c2ccncc2)c(-c2cnco2)n1)C1CC1
InChIInChI=1S/C17H14N4O2/c22-17(12-1-2-12)21-15-4-3-13(11-5-7-18-8-6-11)16(20-15)14-9-19-10-23-14/h3-10,12H,1-2H2,(H,20,21,22)
InChIKeyFKVPNOVTCOJFFH-UHFFFAOYSA-N
MW306.32 g/mol
LogP3.15
Rot. Bonds4

About N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide

N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide (PubChem CID 46880470) has the molecular formula C17H14N4O2 and a molecular weight of 306.32 g/mol. Its IUPAC name is N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide
PubChem CID46880470
Molecular FormulaC17H14N4O2
Molecular Weight306.32 g/mol
Exact Mass306.11
IUPAC NameN-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(-c2ccncc2)c(-c2cnco2)n1)C1CC1
InChIInChI=1S/C17H14N4O2/c22-17(12-1-2-12)21-15-4-3-13(11-5-7-18-8-6-11)16(20-15)14-9-19-10-23-14/h3-10,12H,1-2H2,(H,20,21,22)
InChIKeyFKVPNOVTCOJFFH-UHFFFAOYSA-N
XLogP3.15
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.32
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide (CID 46880470) is N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide is O=C(Nc1ccc(-c2ccncc2)c(-c2cnco2)n1)C1CC1.
What is the InChIKey of N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide?
The InChIKey is FKVPNOVTCOJFFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O2/c22-17(12-1-2-12)21-15-4-3-13(11-5-7-18-8-6-11)16(20-15)14-9-19-10-23-14/h3-10,12H,1-2H2,(H,20,21,22).
What are the key properties of N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide?
N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide has a molecular weight of 306.32 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1,3-oxazol-5-yl)-5-pyridin-4-yl-2-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 46880470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).