N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide

C20H17N3O3 — CID 22176723

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide
SMILESO=C(Cc1cc2oc3ccccc3c2cc1O)Nc1cc(C2CC2)[nH]n1
InChIInChI=1S/C20H17N3O3/c24-16-9-14-13-3-1-2-4-17(13)26-18(14)7-12(16)8-20(25)21-19-10-15(22-23-19)11-5-6-11/h1-4,7,9-11,24H,5-6,8H2,(H2,21,22,23,25)
InChIKeyDDXHHOIJLVOMPU-UHFFFAOYSA-N
MW347.37 g/mol
LogP4.07
Rot. Bonds4

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide (PubChem CID 22176723) has the molecular formula C20H17N3O3 and a molecular weight of 347.37 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide
PubChem CID22176723
Molecular FormulaC20H17N3O3
Molecular Weight347.37 g/mol
Exact Mass347.13
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide
SMILESO=C(Cc1cc2oc3ccccc3c2cc1O)Nc1cc(C2CC2)[nH]n1
InChIInChI=1S/C20H17N3O3/c24-16-9-14-13-3-1-2-4-17(13)26-18(14)7-12(16)8-20(25)21-19-10-15(22-23-19)11-5-6-11/h1-4,7,9-11,24H,5-6,8H2,(H2,21,22,23,25)
InChIKeyDDXHHOIJLVOMPU-UHFFFAOYSA-N
XLogP4.07
TPSA91.15 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.37
LogP ≤ 54.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide (CID 22176723) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide is O=C(Cc1cc2oc3ccccc3c2cc1O)Nc1cc(C2CC2)[nH]n1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide?
The InChIKey is DDXHHOIJLVOMPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O3/c24-16-9-14-13-3-1-2-4-17(13)26-18(14)7-12(16)8-20(25)21-19-10-15(22-23-19)11-5-6-11/h1-4,7,9-11,24H,5-6,8H2,(H2,21,22,23,25).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide has a molecular weight of 347.37 g/mol, XLogP of 4.07, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(2-hydroxydibenzofuran-3-yl)acetamide is sourced from PubChem (CID 22176723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).