N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide

C20H15N3O2 — CID 17403437

IUPACN-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide
SMILESO=C(Cc1n[nH]c(=O)c2ccccc12)Nc1cccc2ccccc12
InChIInChI=1S/C20H15N3O2/c24-19(21-17-11-5-7-13-6-1-2-8-14(13)17)12-18-15-9-3-4-10-16(15)20(25)23-22-18/h1-11H,12H2,(H,21,24)(H,23,25)
InChIKeyHYTQMQBNGHBSNW-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.26
Rot. Bonds3

About N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide

N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide (PubChem CID 17403437) has the molecular formula C20H15N3O2 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide.

Molecular Properties

Compound NameN-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide
PubChem CID17403437
Molecular FormulaC20H15N3O2
Molecular Weight329.36 g/mol
Exact Mass329.12
IUPAC NameN-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide
SMILESO=C(Cc1n[nH]c(=O)c2ccccc12)Nc1cccc2ccccc12
InChIInChI=1S/C20H15N3O2/c24-19(21-17-11-5-7-13-6-1-2-8-14(13)17)12-18-15-9-3-4-10-16(15)20(25)23-22-18/h1-11H,12H2,(H,21,24)(H,23,25)
InChIKeyHYTQMQBNGHBSNW-UHFFFAOYSA-N
XLogP3.26
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylphenyl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide
CID 8839355
2-(4-oxo-3H-phthalazin-1-yl)-N-(5-phenyl-1H-pyrazol-3-yl)acetamide
CID 166198338
N-(4-chloro-2-fluorophenyl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide
CID 7901318
N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide
CID 9117000
N-(4-cyanophenyl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide
CID 26703210
N-(5-methyl-2-pyridinyl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide
CID 18106765
N-(3-methylsulfanylphenyl)-2-(4-oxo-3H-phthalazin-1-yl)acetamide
CID 4802653
2-(4-oxo-3H-phthalazin-1-yl)-N-propylacetamide
CID 17394362
N-[2-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]acetamide
CID 122191897
2-(4-oxo-3H-phthalazin-1-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 139017463
[2-(2-methoxyanilino)-2-oxoethyl] 2-(4-oxo-3H-phthalazin-1-yl)acetate
CID 7251522
N,N'-dinaphthalen-1-ylbutanediamide
CID 1346643

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide?
The IUPAC name of N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide (CID 17403437) is N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide.
What is the SMILES notation for N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide?
The canonical SMILES for N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide is O=C(Cc1n[nH]c(=O)c2ccccc12)Nc1cccc2ccccc12.
What is the InChIKey of N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide?
The InChIKey is HYTQMQBNGHBSNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O2/c24-19(21-17-11-5-7-13-6-1-2-8-14(13)17)12-18-15-9-3-4-10-16(15)20(25)23-22-18/h1-11H,12H2,(H,21,24)(H,23,25).
What are the key properties of N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide?
N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide has a molecular weight of 329.36 g/mol, XLogP of 3.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-2-(4-oxo-3H-phthalazin-1-yl)acetamide is sourced from PubChem (CID 17403437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).