1-methoxy-9H-carbazole;oxirane

C15H15NO2 — CID 175234481

IUPAC1-methoxy-9H-carbazole;oxirane
SMILESC1CO1.COc1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C13H11NO.C2H4O/c1-15-12-8-4-6-10-9-5-2-3-7-11(9)14-13(10)12;1-2-3-1/h2-8,14H,1H3;1-2H2
InChIKeyXTDGJBAGMYFAQU-UHFFFAOYSA-N
MW241.29 g/mol
LogP3.35
Rot. Bonds1

About 1-methoxy-9H-carbazole;oxirane

1-methoxy-9H-carbazole;oxirane (PubChem CID 175234481) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 1-methoxy-9H-carbazole;oxirane.

Molecular Properties

Compound Name1-methoxy-9H-carbazole;oxirane
PubChem CID175234481
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Name1-methoxy-9H-carbazole;oxirane
SMILESC1CO1.COc1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C13H11NO.C2H4O/c1-15-12-8-4-6-10-9-5-2-3-7-11(9)14-13(10)12;1-2-3-1/h2-8,14H,1H3;1-2H2
InChIKeyXTDGJBAGMYFAQU-UHFFFAOYSA-N
XLogP3.35
TPSA37.55 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

8-methoxy-9H-pyrido[3,4-b]indole
CID 22185224
6-methoxy-5H-pyrido[4,3-b]indole
CID 91665960
1-(4-methylphenoxy)-9H-carbazole
CID 141175510
bis(9H-carbazol-1-yloxy)borinic acid
CID 175014324
7,14,16-trimethoxy-9,18,21-triazaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.022,27]heptacosa-1,3(8),4,6,10,12(17),13,15,19,22,24,26-dodecaene
CID 175429308
1-methoxynaphthalene;oxetane
CID 90030663
1-methoxy-5,7-dihydroindolo[2,3-b]carbazole
CID 141287625
1-(2-ethoxyphenyl)-9H-carbazole
CID 175136892
7-methoxy-3,15-diazahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4(9),5,7,11,14(22),16,18,20,23-undecaene
CID 24774105
1-[2-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 66618059
1-(9H-carbazol-1-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-one
CID 171380184
4-methoxy-10H-indolo[3,2-b]quinoline-11-carboxylic acid
CID 10493837

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-9H-carbazole;oxirane?
The IUPAC name of 1-methoxy-9H-carbazole;oxirane (CID 175234481) is 1-methoxy-9H-carbazole;oxirane.
What is the SMILES notation for 1-methoxy-9H-carbazole;oxirane?
The canonical SMILES for 1-methoxy-9H-carbazole;oxirane is C1CO1.COc1cccc2c1[nH]c1ccccc12.
What is the InChIKey of 1-methoxy-9H-carbazole;oxirane?
The InChIKey is XTDGJBAGMYFAQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO.C2H4O/c1-15-12-8-4-6-10-9-5-2-3-7-11(9)14-13(10)12;1-2-3-1/h2-8,14H,1H3;1-2H2.
What are the key properties of 1-methoxy-9H-carbazole;oxirane?
1-methoxy-9H-carbazole;oxirane has a molecular weight of 241.29 g/mol, XLogP of 3.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-9H-carbazole;oxirane is sourced from PubChem (CID 175234481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).