N-(9-methylidene-10-oxoanthracen-1-yl)acetamide

C17H13NO2 — CID 138614732

IUPACN-(9-methylidene-10-oxoanthracen-1-yl)acetamide
SMILESC=C1c2ccccc2C(=O)c2cccc(NC(C)=O)c21
InChIInChI=1S/C17H13NO2/c1-10-12-6-3-4-7-13(12)17(20)14-8-5-9-15(16(10)14)18-11(2)19/h3-9H,1H2,2H3,(H,18,19)
InChIKeySLUBNIDLXWUKIS-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.25
Rot. Bonds1

About N-(9-methylidene-10-oxoanthracen-1-yl)acetamide

N-(9-methylidene-10-oxoanthracen-1-yl)acetamide (PubChem CID 138614732) has the molecular formula C17H13NO2 and a molecular weight of 263.30 g/mol. Its IUPAC name is N-(9-methylidene-10-oxoanthracen-1-yl)acetamide.

Molecular Properties

Compound NameN-(9-methylidene-10-oxoanthracen-1-yl)acetamide
PubChem CID138614732
Molecular FormulaC17H13NO2
Molecular Weight263.30 g/mol
Exact Mass263.09
IUPAC NameN-(9-methylidene-10-oxoanthracen-1-yl)acetamide
SMILESC=C1c2ccccc2C(=O)c2cccc(NC(C)=O)c21
InChIInChI=1S/C17H13NO2/c1-10-12-6-3-4-7-13(12)17(20)14-8-5-9-15(16(10)14)18-11(2)19/h3-9H,1H2,2H3,(H,18,19)
InChIKeySLUBNIDLXWUKIS-UHFFFAOYSA-N
XLogP3.25
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-anilino-10-methylideneanthracen-9-one
CID 56629150
methyl N-(9,10-dioxoanthracen-1-yl)carbamate
CID 4161864
N-(1,3,4-trioxoisoquinolin-5-yl)acetamide
CID 11572178
N-(6-bromo-7-methyl-5,8-dioxonaphthalen-1-yl)acetamide
CID 70291421
N-(4-acetyl-9,10-dioxoanthracen-1-yl)acetamide
CID 165362960
N-(9,10-dioxoanthracen-1-yl)-9,10-dioxoanthracene-1-carboxamide
CID 3343697
N-(1,3-dioxo-2-benzofuran-4-yl)acetamide;ethane
CID 143956506
2-bromo-N-(9,10-dioxoanthracen-1-yl)acetamide
CID 24884684
N-(4-anilino-9,10-dioxoanthracen-1-yl)acetamide
CID 5166275
N'-(2,6-dimethylphenyl)-N-(9,10-dioxoanthracen-1-yl)oxamide
CID 13439298
N-(5-amino-9,10-dioxoanthracen-1-yl)acetamide;N-(5-amino-9,10-dioxoanthracen-1-yl)benzamide
CID 19828301
(9,10-dioxoanthracen-1-yl)thiourea
CID 82030669

Frequently Asked Questions

What is the IUPAC name of N-(9-methylidene-10-oxoanthracen-1-yl)acetamide?
The IUPAC name of N-(9-methylidene-10-oxoanthracen-1-yl)acetamide (CID 138614732) is N-(9-methylidene-10-oxoanthracen-1-yl)acetamide.
What is the SMILES notation for N-(9-methylidene-10-oxoanthracen-1-yl)acetamide?
The canonical SMILES for N-(9-methylidene-10-oxoanthracen-1-yl)acetamide is C=C1c2ccccc2C(=O)c2cccc(NC(C)=O)c21.
What is the InChIKey of N-(9-methylidene-10-oxoanthracen-1-yl)acetamide?
The InChIKey is SLUBNIDLXWUKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO2/c1-10-12-6-3-4-7-13(12)17(20)14-8-5-9-15(16(10)14)18-11(2)19/h3-9H,1H2,2H3,(H,18,19).
What are the key properties of N-(9-methylidene-10-oxoanthracen-1-yl)acetamide?
N-(9-methylidene-10-oxoanthracen-1-yl)acetamide has a molecular weight of 263.30 g/mol, XLogP of 3.25, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-methylidene-10-oxoanthracen-1-yl)acetamide is sourced from PubChem (CID 138614732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).