N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide

C15H14N4O2 — CID 24790941

IUPACN-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide
SMILESO=C(CCn1cccn1)Nc1ccc(-c2ccno2)cc1
InChIInChI=1S/C15H14N4O2/c20-15(7-11-19-10-1-8-16-19)18-13-4-2-12(3-5-13)14-6-9-17-21-14/h1-6,8-10H,7,11H2,(H,18,20)
InChIKeyPKJOBSNTZDSBKP-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.57
Rot. Bonds5

About N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide

N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide (PubChem CID 24790941) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide
PubChem CID24790941
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC NameN-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide
SMILESO=C(CCn1cccn1)Nc1ccc(-c2ccno2)cc1
InChIInChI=1S/C15H14N4O2/c20-15(7-11-19-10-1-8-16-19)18-13-4-2-12(3-5-13)14-6-9-17-21-14/h1-6,8-10H,7,11H2,(H,18,20)
InChIKeyPKJOBSNTZDSBKP-UHFFFAOYSA-N
XLogP2.57
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide?
The IUPAC name of N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide (CID 24790941) is N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide?
The canonical SMILES for N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide is O=C(CCn1cccn1)Nc1ccc(-c2ccno2)cc1.
What is the InChIKey of N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide?
The InChIKey is PKJOBSNTZDSBKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c20-15(7-11-19-10-1-8-16-19)18-13-4-2-12(3-5-13)14-6-9-17-21-14/h1-6,8-10H,7,11H2,(H,18,20).
What are the key properties of N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide?
N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide has a molecular weight of 282.30 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1,2-oxazol-5-yl)phenyl]-3-pyrazol-1-ylpropanamide is sourced from PubChem (CID 24790941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).