methyl 2-carbazol-9-ylacetate

C15H13NO2 — CID 3745219

IUPACmethyl 2-carbazol-9-ylacetate
SMILESCOC(=O)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C15H13NO2/c1-18-15(17)10-16-13-8-4-2-6-11(13)12-7-3-5-9-14(12)16/h2-9H,10H2,1H3
InChIKeyPXUBYWRPKULBNC-UHFFFAOYSA-N
MW239.27 g/mol
LogP2.97
Rot. Bonds2

About methyl 2-carbazol-9-ylacetate

methyl 2-carbazol-9-ylacetate (PubChem CID 3745219) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is methyl 2-carbazol-9-ylacetate.

Molecular Properties

Compound Namemethyl 2-carbazol-9-ylacetate
PubChem CID3745219
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Namemethyl 2-carbazol-9-ylacetate
SMILESCOC(=O)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C15H13NO2/c1-18-15(17)10-16-13-8-4-2-6-11(13)12-7-3-5-9-14(12)16/h2-9H,10H2,1H3
InChIKeyPXUBYWRPKULBNC-UHFFFAOYSA-N
XLogP2.97
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[3-(2-methoxy-2-oxoethyl)-2,4-dioxoquinazolin-1-yl]acetate
CID 1265260
methyl 2-(4-methyl-2-oxoquinolin-1-yl)acetate
CID 39767914
methyl 2-(4-tert-butyl-2-oxoquinazolin-1-yl)acetate
CID 22973079
methyl 2-(3-benzyl-2,4-dioxoquinazolin-1-yl)acetate
CID 154831058
methyl 2-[2-hydroxy-3-(methoxycarbonyldiazenyl)indol-1-yl]acetate
CID 932258
methyl 2-[3-[(E)-3-amino-3-oxoprop-1-enyl]-2-methylindol-1-yl]acetate
CID 170877439
methyl 2-(3-oxo-2H-indazol-1-yl)acetate
CID 15084551
methyl 2-(3-chloroindol-1-yl)acetate
CID 62805557
cyclohexyl 2-carbazol-9-ylacetate
CID 12010465
(2,4,5-trichlorophenyl) 2-carbazol-9-ylacetate
CID 14920378
carbazol-9-ylmethyl propanoate
CID 122502701
phenyl 2-(9-oxoacridin-10-yl)acetate
CID 3113744

Frequently Asked Questions

What is the IUPAC name of methyl 2-carbazol-9-ylacetate?
The IUPAC name of methyl 2-carbazol-9-ylacetate (CID 3745219) is methyl 2-carbazol-9-ylacetate.
What is the SMILES notation for methyl 2-carbazol-9-ylacetate?
The canonical SMILES for methyl 2-carbazol-9-ylacetate is COC(=O)Cn1c2ccccc2c2ccccc21.
What is the InChIKey of methyl 2-carbazol-9-ylacetate?
The InChIKey is PXUBYWRPKULBNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2/c1-18-15(17)10-16-13-8-4-2-6-11(13)12-7-3-5-9-14(12)16/h2-9H,10H2,1H3.
What are the key properties of methyl 2-carbazol-9-ylacetate?
methyl 2-carbazol-9-ylacetate has a molecular weight of 239.27 g/mol, XLogP of 2.97, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-carbazol-9-ylacetate is sourced from PubChem (CID 3745219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).