methyl 2-methoxy-9H-carbazole-3-carboxylate

C15H13NO3 — CID 24898872

IUPACmethyl 2-methoxy-9H-carbazole-3-carboxylate
SMILESCOC(=O)c1cc2c(cc1OC)[nH]c1ccccc12
InChIInChI=1S/C15H13NO3/c1-18-14-8-13-10(7-11(14)15(17)19-2)9-5-3-4-6-12(9)16-13/h3-8,16H,1-2H3
InChIKeyBYDOYRHWHKPKQP-UHFFFAOYSA-N
MW255.27 g/mol
LogP3.12
Rot. Bonds2

About methyl 2-methoxy-9H-carbazole-3-carboxylate

methyl 2-methoxy-9H-carbazole-3-carboxylate (PubChem CID 24898872) has the molecular formula C15H13NO3 and a molecular weight of 255.27 g/mol. Its IUPAC name is methyl 2-methoxy-9H-carbazole-3-carboxylate.

Molecular Properties

Compound Namemethyl 2-methoxy-9H-carbazole-3-carboxylate
PubChem CID24898872
Molecular FormulaC15H13NO3
Molecular Weight255.27 g/mol
Exact Mass255.09
IUPAC Namemethyl 2-methoxy-9H-carbazole-3-carboxylate
SMILESCOC(=O)c1cc2c(cc1OC)[nH]c1ccccc12
InChIInChI=1S/C15H13NO3/c1-18-14-8-13-10(7-11(14)15(17)19-2)9-5-3-4-6-12(9)16-13/h3-8,16H,1-2H3
InChIKeyBYDOYRHWHKPKQP-UHFFFAOYSA-N
XLogP3.12
TPSA51.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methyl 2-methoxy-9H-carbazole-3-carboxylate?
The IUPAC name of methyl 2-methoxy-9H-carbazole-3-carboxylate (CID 24898872) is methyl 2-methoxy-9H-carbazole-3-carboxylate.
What is the SMILES notation for methyl 2-methoxy-9H-carbazole-3-carboxylate?
The canonical SMILES for methyl 2-methoxy-9H-carbazole-3-carboxylate is COC(=O)c1cc2c(cc1OC)[nH]c1ccccc12.
What is the InChIKey of methyl 2-methoxy-9H-carbazole-3-carboxylate?
The InChIKey is BYDOYRHWHKPKQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO3/c1-18-14-8-13-10(7-11(14)15(17)19-2)9-5-3-4-6-12(9)16-13/h3-8,16H,1-2H3.
What are the key properties of methyl 2-methoxy-9H-carbazole-3-carboxylate?
methyl 2-methoxy-9H-carbazole-3-carboxylate has a molecular weight of 255.27 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methoxy-9H-carbazole-3-carboxylate is sourced from PubChem (CID 24898872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).