methyl 9-methylcarbazole-3-carboxylate

C15H13NO2 — CID 10037251

IUPACmethyl 9-methylcarbazole-3-carboxylate
SMILESCOC(=O)c1ccc2c(c1)c1ccccc1n2C
InChIInChI=1S/C15H13NO2/c1-16-13-6-4-3-5-11(13)12-9-10(15(17)18-2)7-8-14(12)16/h3-9H,1-2H3
InChIKeyKUVUDVZSLTYSOQ-UHFFFAOYSA-N
MW239.27 g/mol
LogP3.12
Rot. Bonds1

About methyl 9-methylcarbazole-3-carboxylate

methyl 9-methylcarbazole-3-carboxylate (PubChem CID 10037251) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is methyl 9-methylcarbazole-3-carboxylate.

Molecular Properties

Compound Namemethyl 9-methylcarbazole-3-carboxylate
PubChem CID10037251
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Namemethyl 9-methylcarbazole-3-carboxylate
SMILESCOC(=O)c1ccc2c(c1)c1ccccc1n2C
InChIInChI=1S/C15H13NO2/c1-16-13-6-4-3-5-11(13)12-9-10(15(17)18-2)7-8-14(12)16/h3-9H,1-2H3
InChIKeyKUVUDVZSLTYSOQ-UHFFFAOYSA-N
XLogP3.12
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methyl 9-methylcarbazole-3-carboxylate?
The IUPAC name of methyl 9-methylcarbazole-3-carboxylate (CID 10037251) is methyl 9-methylcarbazole-3-carboxylate.
What is the SMILES notation for methyl 9-methylcarbazole-3-carboxylate?
The canonical SMILES for methyl 9-methylcarbazole-3-carboxylate is COC(=O)c1ccc2c(c1)c1ccccc1n2C.
What is the InChIKey of methyl 9-methylcarbazole-3-carboxylate?
The InChIKey is KUVUDVZSLTYSOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2/c1-16-13-6-4-3-5-11(13)12-9-10(15(17)18-2)7-8-14(12)16/h3-9H,1-2H3.
What are the key properties of methyl 9-methylcarbazole-3-carboxylate?
methyl 9-methylcarbazole-3-carboxylate has a molecular weight of 239.27 g/mol, XLogP of 3.12, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 9-methylcarbazole-3-carboxylate is sourced from PubChem (CID 10037251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).