N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide

C20H16N4O2 — CID 78890208

IUPACN-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
SMILESO=C(Nc1ccc(-c2cnco2)cc1)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C20H16N4O2/c25-20(17-4-2-15(3-5-17)13-24-11-1-10-22-24)23-18-8-6-16(7-9-18)19-12-21-14-26-19/h1-12,14H,13H2,(H,23,25)
InChIKeyLHJUJSTZRFXLTL-UHFFFAOYSA-N
MW344.37 g/mol
LogP3.84
Rot. Bonds5

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

N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide (PubChem CID 78890208) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide.

Molecular Properties

Compound NameN-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
PubChem CID78890208
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC NameN-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
SMILESO=C(Nc1ccc(-c2cnco2)cc1)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C20H16N4O2/c25-20(17-4-2-15(3-5-17)13-24-11-1-10-22-24)23-18-8-6-16(7-9-18)19-12-21-14-26-19/h1-12,14H,13H2,(H,23,25)
InChIKeyLHJUJSTZRFXLTL-UHFFFAOYSA-N
XLogP3.84
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(1,3-oxazol-5-yl)phenyl]-2-pyrazol-1-ylacetamide
CID 141085051
4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
CID 60811320
N-[4-(diethylamino)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 134036419
N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 111116122
N-[4-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-4-carboxamide
CID 60934045
4-(pyrazol-1-ylmethyl)-N-thiophen-3-ylbenzamide
CID 175249041
4-propan-2-ylsulfonyl-N-[4-(pyrazol-1-ylmethyl)phenyl]benzamide
CID 55970703
3-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
CID 60810765
N-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 55501140
N-[2-(furan-2-yl)-3H-benzimidazol-5-yl]-4-(pyrazol-1-ylmethyl)benzamide
CID 52692587
2-chloro-4-[[4-(pyrazol-1-ylmethyl)benzoyl]amino]benzamide
CID 39170149
N-(2-methyl-1,3-benzoxazol-6-yl)-4-(pyrazol-1-ylmethyl)benzamide
CID 86921797

Frequently Asked Questions

What is the IUPAC name of N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
The IUPAC name of N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide (CID 78890208) is N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide.
What is the SMILES notation for N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
The canonical SMILES for N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide is O=C(Nc1ccc(-c2cnco2)cc1)c1ccc(Cn2cccn2)cc1.
What is the InChIKey of N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
The InChIKey is LHJUJSTZRFXLTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c25-20(17-4-2-15(3-5-17)13-24-11-1-10-22-24)23-18-8-6-16(7-9-18)19-12-21-14-26-19/h1-12,14H,13H2,(H,23,25).
What are the key properties of N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide has a molecular weight of 344.37 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide is sourced from PubChem (CID 78890208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).