N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide

C20H20N2O2 — CID 6622658

IUPACN-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide
SMILESCc1ncoc1C(=O)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20N2O2/c1-15-19(24-14-22-15)20(23)21-13-12-18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,14,18H,12-13H2,1H3,(H,21,23)
InChIKeyVLWCFQHPELTTPN-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.94
Rot. Bonds6

About N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide

N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide (PubChem CID 6622658) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide
PubChem CID6622658
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC NameN-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide
SMILESCc1ncoc1C(=O)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20N2O2/c1-15-19(24-14-22-15)20(23)21-13-12-18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,14,18H,12-13H2,1H3,(H,21,23)
InChIKeyVLWCFQHPELTTPN-UHFFFAOYSA-N
XLogP3.94
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide (CID 6622658) is N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide is Cc1ncoc1C(=O)NCCC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide?
The InChIKey is VLWCFQHPELTTPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-15-19(24-14-22-15)20(23)21-13-12-18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,14,18H,12-13H2,1H3,(H,21,23).
What are the key properties of N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide?
N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide has a molecular weight of 320.39 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-diphenylpropyl)-4-methyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 6622658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).