ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate

C18H16N2O2 — CID 11358301

IUPACethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate
SMILESCCOC(=O)c1cc2ccc3c4cc(C)ccc4[nH]c3c2[nH]1
InChIInChI=1S/C18H16N2O2/c1-3-22-18(21)15-9-11-5-6-12-13-8-10(2)4-7-14(13)19-17(12)16(11)20-15/h4-9,19-20H,3H2,1-2H3
InChIKeyKWGMPSIMTBPUCP-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.29
Rot. Bonds2

About ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate

ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate (PubChem CID 11358301) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate.

Molecular Properties

Compound Nameethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate
PubChem CID11358301
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Nameethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate
SMILESCCOC(=O)c1cc2ccc3c4cc(C)ccc4[nH]c3c2[nH]1
InChIInChI=1S/C18H16N2O2/c1-3-22-18(21)15-9-11-5-6-12-13-8-10(2)4-7-14(13)19-17(12)16(11)20-15/h4-9,19-20H,3H2,1-2H3
InChIKeyKWGMPSIMTBPUCP-UHFFFAOYSA-N
XLogP4.29
TPSA57.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate?
The IUPAC name of ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate (CID 11358301) is ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate.
What is the SMILES notation for ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate?
The canonical SMILES for ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate is CCOC(=O)c1cc2ccc3c4cc(C)ccc4[nH]c3c2[nH]1.
What is the InChIKey of ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate?
The InChIKey is KWGMPSIMTBPUCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-3-22-18(21)15-9-11-5-6-12-13-8-10(2)4-7-14(13)19-17(12)16(11)20-15/h4-9,19-20H,3H2,1-2H3.
What are the key properties of ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate?
ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate has a molecular weight of 292.34 g/mol, XLogP of 4.29, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 7-methyl-1,10-dihydropyrrolo[2,3-a]carbazole-2-carboxylate is sourced from PubChem (CID 11358301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).