N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide

C14H9ClN2O2 — CID 168651697

IUPACN-(5-chloro-9-oxo-10H-acridin-4-yl)formamide
SMILESO=CNc1cccc2c(=O)c3cccc(Cl)c3[nH]c12
InChIInChI=1S/C14H9ClN2O2/c15-10-5-1-3-8-12(10)17-13-9(14(8)19)4-2-6-11(13)16-7-18/h1-7H,(H,16,18)(H,17,19)
InChIKeyOSNCPVKGRIAILY-UHFFFAOYSA-N
MW272.69 g/mol
LogP2.90
Rot. Bonds2

About N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide

N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide (PubChem CID 168651697) has the molecular formula C14H9ClN2O2 and a molecular weight of 272.69 g/mol. Its IUPAC name is N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide.

Molecular Properties

Compound NameN-(5-chloro-9-oxo-10H-acridin-4-yl)formamide
PubChem CID168651697
Molecular FormulaC14H9ClN2O2
Molecular Weight272.69 g/mol
Exact Mass272.04
IUPAC NameN-(5-chloro-9-oxo-10H-acridin-4-yl)formamide
SMILESO=CNc1cccc2c(=O)c3cccc(Cl)c3[nH]c12
InChIInChI=1S/C14H9ClN2O2/c15-10-5-1-3-8-12(10)17-13-9(14(8)19)4-2-6-11(13)16-7-18/h1-7H,(H,16,18)(H,17,19)
InChIKeyOSNCPVKGRIAILY-UHFFFAOYSA-N
XLogP2.90
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.69
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

N-(2,3-dimethyl-1H-indol-7-yl)formamide
CID 174861152
5-chloro-9-oxo-10H-acridine-4-carboxylic acid
CID 620439
N-(2-bromo-3-chlorophenyl)formamide
CID 103480075
N-(8-formamido-9H-carbazol-2-yl)formamide
CID 174862208
N-(6,7,8,9-tetrahydro-5H-carbazol-1-yl)formamide
CID 174983433
4-chloro-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione;4,11-dichloro-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione
CID 162179481
N-(2-oxo-1H-pyridin-3-yl)formamide
CID 21101580
3,11-dichloro-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione
CID 58880554
methyl N'-(5-chloro-9-oxo-10H-acridin-4-yl)-N-cyanocarbamimidothioate
CID 169364249
N-(9H-carbazol-4-yl)formamide
CID 174728433
N-(2-benzyl-3-chlorophenyl)formamide
CID 19426648
6-chloro-5H-pyridazino[4,5-b]indole-1,4-dione
CID 19030664

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide?
The IUPAC name of N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide (CID 168651697) is N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide.
What is the SMILES notation for N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide?
The canonical SMILES for N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide is O=CNc1cccc2c(=O)c3cccc(Cl)c3[nH]c12.
What is the InChIKey of N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide?
The InChIKey is OSNCPVKGRIAILY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O2/c15-10-5-1-3-8-12(10)17-13-9(14(8)19)4-2-6-11(13)16-7-18/h1-7H,(H,16,18)(H,17,19).
What are the key properties of N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide?
N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide has a molecular weight of 272.69 g/mol, XLogP of 2.90, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-9-oxo-10H-acridin-4-yl)formamide is sourced from PubChem (CID 168651697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).