5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide

C12H10N4O3 — CID 54897309

IUPAC5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide
SMILESO=C(NCc1cn[nH]c1)c1cc(-c2ccco2)on1
InChIInChI=1S/C12H10N4O3/c17-12(13-5-8-6-14-15-7-8)9-4-11(19-16-9)10-2-1-3-18-10/h1-4,6-7H,5H2,(H,13,17)(H,14,15)
InChIKeyNHUUOSDBPFBVQW-UHFFFAOYSA-N
MW258.24 g/mol
LogP1.59
Rot. Bonds4

About 5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide

5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide (PubChem CID 54897309) has the molecular formula C12H10N4O3 and a molecular weight of 258.24 g/mol. Its IUPAC name is 5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide
PubChem CID54897309
Molecular FormulaC12H10N4O3
Molecular Weight258.24 g/mol
Exact Mass258.08
IUPAC Name5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide
SMILESO=C(NCc1cn[nH]c1)c1cc(-c2ccco2)on1
InChIInChI=1S/C12H10N4O3/c17-12(13-5-8-6-14-15-7-8)9-4-11(19-16-9)10-2-1-3-18-10/h1-4,6-7H,5H2,(H,13,17)(H,14,15)
InChIKeyNHUUOSDBPFBVQW-UHFFFAOYSA-N
XLogP1.59
TPSA96.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.24
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(furan-2-yl)-N-(2-methoxyethyl)-1,2-oxazole-3-carboxamide
CID 15995731
5-(furan-2-yl)-N-[2-(4-hydroxyphenyl)ethyl]-1,2-oxazole-3-carboxamide
CID 24739766
5-(furan-2-yl)-N-(2-pyridin-4-ylethyl)-1,2-oxazole-3-carboxamide
CID 24720451
ethyl 2-[[5-(furan-2-yl)-1,2-oxazole-3-carbonyl]amino]acetate
CID 47257374
N-(2-amino-2-ethylbutyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 119643486
5-(furan-2-yl)-N-(2-methylsulfonylethyl)-1,2-oxazole-3-carboxamide
CID 110357164
N-(3,3-difluoro-2-hydroxypropyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 103770495
5-(furan-2-yl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-1,2-oxazole-3-carboxamide;hydrochloride
CID 120944619
N-[2-ethyl-2-(hydroxymethyl)butyl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 103843592
5-(furan-2-yl)-N-(2-methoxypyrimidin-5-yl)-1,2-oxazole-3-carboxamide
CID 122301502
N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 110304153
5-(furan-2-yl)-N-[2-(4-propan-2-ylphenyl)ethyl]-1,2-oxazole-3-carboxamide
CID 110307679

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide (CID 54897309) is 5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide is O=C(NCc1cn[nH]c1)c1cc(-c2ccco2)on1.
What is the InChIKey of 5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is NHUUOSDBPFBVQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4O3/c17-12(13-5-8-6-14-15-7-8)9-4-11(19-16-9)10-2-1-3-18-10/h1-4,6-7H,5H2,(H,13,17)(H,14,15).
What are the key properties of 5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide?
5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 258.24 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 54897309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).