4-methylselenopheno[2,3-b]indole

C11H9NSe — CID 155771410

IUPAC4-methylselenopheno[2,3-b]indole
SMILESCn1c2ccccc2c2cc[se]c21
InChIInChI=1S/C11H9NSe/c1-12-10-5-3-2-4-8(10)9-6-7-13-11(9)12/h2-7H,1H3
InChIKeyNWQJZNNCRFREAJ-UHFFFAOYSA-N
MW234.16 g/mol
LogP2.39
Rot. Bonds

About 4-methylselenopheno[2,3-b]indole

4-methylselenopheno[2,3-b]indole (PubChem CID 155771410) has the molecular formula C11H9NSe and a molecular weight of 234.16 g/mol. Its IUPAC name is 4-methylselenopheno[2,3-b]indole.

Molecular Properties

Compound Name4-methylselenopheno[2,3-b]indole
PubChem CID155771410
Molecular FormulaC11H9NSe
Molecular Weight234.16 g/mol
Exact Mass234.99
IUPAC Name4-methylselenopheno[2,3-b]indole
SMILESCn1c2ccccc2c2cc[se]c21
InChIInChI=1S/C11H9NSe/c1-12-10-5-3-2-4-8(10)9-6-7-13-11(9)12/h2-7H,1H3
InChIKeyNWQJZNNCRFREAJ-UHFFFAOYSA-N
XLogP2.39
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.16
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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8-methyl-8-azapentacyclo[20.4.0.02,7.09,14.015,20]hexacosa-1(26),2,4,6,9,11,13,15,17,19,22,24-dodecaen-21-one
CID 167125984
9H-carbazole;9-methylcarbazole
CID 142567226
ethane;9-methyl-3-(9-methylcarbazol-3-yl)carbazole
CID 158738351
(Z)-but-2-ene;ethane;9-methylcarbazole;prop-1-ene
CID 144690725
ethane;9-methylcarbazole;9-phenylcarbazole
CID 159293304
16,20-dimethyl-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14(19),15,17,21,23-dodecaene
CID 164939565
2-(1,3-dimethylindol-2-yl)-1,3-dimethylindole
CID 12742686
10-methyl-14,21-diphenyl-10-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaene
CID 58131761
9-methylpyrido[2,3-b]indole
CID 12596580

Frequently Asked Questions

What is the IUPAC name of 4-methylselenopheno[2,3-b]indole?
The IUPAC name of 4-methylselenopheno[2,3-b]indole (CID 155771410) is 4-methylselenopheno[2,3-b]indole.
What is the SMILES notation for 4-methylselenopheno[2,3-b]indole?
The canonical SMILES for 4-methylselenopheno[2,3-b]indole is Cn1c2ccccc2c2cc[se]c21.
What is the InChIKey of 4-methylselenopheno[2,3-b]indole?
The InChIKey is NWQJZNNCRFREAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NSe/c1-12-10-5-3-2-4-8(10)9-6-7-13-11(9)12/h2-7H,1H3.
What are the key properties of 4-methylselenopheno[2,3-b]indole?
4-methylselenopheno[2,3-b]indole has a molecular weight of 234.16 g/mol, XLogP of 2.39, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylselenopheno[2,3-b]indole is sourced from PubChem (CID 155771410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).