N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide

C21H20N2O2 — CID 7546299

IUPACN-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NCCC(c1ccccc1)c1ccccc1)c1ccc(=O)[nH]c1
InChIInChI=1S/C21H20N2O2/c24-20-12-11-18(15-23-20)21(25)22-14-13-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,15,19H,13-14H2,(H,22,25)(H,23,24)
InChIKeyWDGKZCSQFVUANE-UHFFFAOYSA-N
MW332.40 g/mol
LogP3.33
Rot. Bonds6

About N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide

N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 7546299) has the molecular formula C21H20N2O2 and a molecular weight of 332.40 g/mol. Its IUPAC name is N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID7546299
Molecular FormulaC21H20N2O2
Molecular Weight332.40 g/mol
Exact Mass332.15
IUPAC NameN-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NCCC(c1ccccc1)c1ccccc1)c1ccc(=O)[nH]c1
InChIInChI=1S/C21H20N2O2/c24-20-12-11-18(15-23-20)21(25)22-14-13-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,15,19H,13-14H2,(H,22,25)(H,23,24)
InChIKeyWDGKZCSQFVUANE-UHFFFAOYSA-N
XLogP3.33
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide (CID 7546299) is N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide is O=C(NCCC(c1ccccc1)c1ccccc1)c1ccc(=O)[nH]c1.
What is the InChIKey of N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is WDGKZCSQFVUANE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O2/c24-20-12-11-18(15-23-20)21(25)22-14-13-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,15,19H,13-14H2,(H,22,25)(H,23,24).
What are the key properties of N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide?
N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 332.40 g/mol, XLogP of 3.33, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-diphenylpropyl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 7546299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).