N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide

C20H19N3O — CID 5330944

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide
SMILESO=C(Nc1cc(C2CC2)[nH]n1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H19N3O/c24-20(21-18-13-17(22-23-18)14-11-12-14)19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,13-14,19H,11-12H2,(H2,21,22,23,24)
InChIKeyYSOORXRSGKEOOP-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.06
Rot. Bonds5

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide (PubChem CID 5330944) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide
PubChem CID5330944
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide
SMILESO=C(Nc1cc(C2CC2)[nH]n1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H19N3O/c24-20(21-18-13-17(22-23-18)14-11-12-14)19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,13-14,19H,11-12H2,(H2,21,22,23,24)
InChIKeyYSOORXRSGKEOOP-UHFFFAOYSA-N
XLogP4.06
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide (CID 5330944) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide is O=C(Nc1cc(C2CC2)[nH]n1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide?
The InChIKey is YSOORXRSGKEOOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c24-20(21-18-13-17(22-23-18)14-11-12-14)19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,13-14,19H,11-12H2,(H2,21,22,23,24).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide has a molecular weight of 317.39 g/mol, XLogP of 4.06, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2,2-diphenylacetamide is sourced from PubChem (CID 5330944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).