N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide

C20H19N3O2 — CID 19887455

IUPACN-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cccn(C2=CC(C)(C)Cc3ccc(C#N)cc32)c1=O
InChIInChI=1S/C20H19N3O2/c1-13(24)22-17-5-4-8-23(19(17)25)18-11-20(2,3)10-15-7-6-14(12-21)9-16(15)18/h4-9,11H,10H2,1-3H3,(H,22,24)
InChIKeyQJCUWRWYENGBNF-UHFFFAOYSA-N
MW333.39 g/mol
LogP3.15
Rot. Bonds2

About N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide

N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide (PubChem CID 19887455) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide
PubChem CID19887455
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC NameN-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cccn(C2=CC(C)(C)Cc3ccc(C#N)cc32)c1=O
InChIInChI=1S/C20H19N3O2/c1-13(24)22-17-5-4-8-23(19(17)25)18-11-20(2,3)10-15-7-6-14(12-21)9-16(15)18/h4-9,11H,10H2,1-3H3,(H,22,24)
InChIKeyQJCUWRWYENGBNF-UHFFFAOYSA-N
XLogP3.15
TPSA74.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6,6-dimethyl-8-(5-nitro-2-oxo-1-pyridinyl)-5H-naphthalene-2-carbonitrile
CID 19887445
N-[1-(6-cyano-2,2-dimethylchromen-4-yl)-2-oxo-3-pyridinyl]formamide
CID 14182561
8-(2-chloro-6-oxo-1-pyridinyl)-6,6-dimethyl-5H-naphthalene-2-carbonitrile
CID 19887441
N-[5-bromo-1-(6-cyano-2,2-dimethylchromen-4-yl)-2-oxo-3-pyridinyl]acetamide
CID 22122714
4-(2-acetylpyrrol-1-yl)-2,2-dimethylchromene-6-carbonitrile
CID 15748996
4H-pyrrolo[1,2-a]indole-6-carbonitrile
CID 102517311
N-(4-cyano-2-fluorophenyl)acetamide
CID 11344323
N-[2-(2-amino-5-cyanophenoxy)phenyl]acetamide
CID 104712475
methyl 7-cyano-1-oxo-3-propan-2-yl-2,4-dihydroisoquinoline-3-carboxylate
CID 102579295
3-amino-4-fluorobenzonitrile;N-(5-cyano-2-fluorophenyl)acetamide
CID 158537950
4-(2-oxo-1-pyridinyl)spiro[chromene-2,1'-cyclobutane]-6-carbonitrile
CID 19347964
4-[4-(4-aminophenyl)-2-oxo-1-pyridinyl]-2,2-dimethylchromene-6-carbonitrile
CID 67887923

Frequently Asked Questions

What is the IUPAC name of N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide?
The IUPAC name of N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide (CID 19887455) is N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide.
What is the SMILES notation for N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide?
The canonical SMILES for N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide is CC(=O)Nc1cccn(C2=CC(C)(C)Cc3ccc(C#N)cc32)c1=O.
What is the InChIKey of N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide?
The InChIKey is QJCUWRWYENGBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-13(24)22-17-5-4-8-23(19(17)25)18-11-20(2,3)10-15-7-6-14(12-21)9-16(15)18/h4-9,11H,10H2,1-3H3,(H,22,24).
What are the key properties of N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide?
N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide has a molecular weight of 333.39 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-2-oxo-3-pyridinyl]acetamide is sourced from PubChem (CID 19887455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).