4-bromo-1-methoxy-9-methylcarbazole

C14H12BrNO — CID 171449091

IUPAC4-bromo-1-methoxy-9-methylcarbazole
SMILESCOc1ccc(Br)c2c3ccccc3n(C)c12
InChIInChI=1S/C14H12BrNO/c1-16-11-6-4-3-5-9(11)13-10(15)7-8-12(17-2)14(13)16/h3-8H,1-2H3
InChIKeyPEHIXFGWAINZFY-UHFFFAOYSA-N
MW290.16 g/mol
LogP4.10
Rot. Bonds1

About 4-bromo-1-methoxy-9-methylcarbazole

4-bromo-1-methoxy-9-methylcarbazole (PubChem CID 171449091) has the molecular formula C14H12BrNO and a molecular weight of 290.16 g/mol. Its IUPAC name is 4-bromo-1-methoxy-9-methylcarbazole.

Molecular Properties

Compound Name4-bromo-1-methoxy-9-methylcarbazole
PubChem CID171449091
Molecular FormulaC14H12BrNO
Molecular Weight290.16 g/mol
Exact Mass289.01
IUPAC Name4-bromo-1-methoxy-9-methylcarbazole
SMILESCOc1ccc(Br)c2c3ccccc3n(C)c12
InChIInChI=1S/C14H12BrNO/c1-16-11-6-4-3-5-9(11)13-10(15)7-8-12(17-2)14(13)16/h3-8H,1-2H3
InChIKeyPEHIXFGWAINZFY-UHFFFAOYSA-N
XLogP4.10
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.16
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-chloro-2-methoxy-9-methylcarbazole
CID 10634135
1-bromo-4-methoxynaphthalene;ethane
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7-(2-bromophenyl)-5,12-dimethylindolo[3,2-a]carbazole
CID 162402293
5,6,7,12-tetramethylindolo[3,2-c]carbazole
CID 134194406
5,11-dimethyl-6,12-dinaphthalen-1-ylindolo[3,2-b]carbazole
CID 163788031
9,10-dimethoxy-14-methyl-4,14-diazapentacyclo[11.7.0.02,6.07,12.015,20]icosa-1(13),2(6),7,9,11,15,17,19-octaen-5-one
CID 132511156
1-(3-bromo-4-methoxyphenyl)indole
CID 175262004
5-iodo-6-(4-methoxyphenyl)-11-methylbenzo[a]carbazole
CID 56931368
ethane;bis(9-methylcarbazole)
CID 159710949
1,3-dihydroxy-2,4-dimethoxy-10-methylacridin-9-one
CID 102480133
4-methoxy-5-methylpyrido[3,2-b]indole-2-carboxylic acid
CID 10563006

Frequently Asked Questions

What is the IUPAC name of 4-bromo-1-methoxy-9-methylcarbazole?
The IUPAC name of 4-bromo-1-methoxy-9-methylcarbazole (CID 171449091) is 4-bromo-1-methoxy-9-methylcarbazole.
What is the SMILES notation for 4-bromo-1-methoxy-9-methylcarbazole?
The canonical SMILES for 4-bromo-1-methoxy-9-methylcarbazole is COc1ccc(Br)c2c3ccccc3n(C)c12.
What is the InChIKey of 4-bromo-1-methoxy-9-methylcarbazole?
The InChIKey is PEHIXFGWAINZFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrNO/c1-16-11-6-4-3-5-9(11)13-10(15)7-8-12(17-2)14(13)16/h3-8H,1-2H3.
What are the key properties of 4-bromo-1-methoxy-9-methylcarbazole?
4-bromo-1-methoxy-9-methylcarbazole has a molecular weight of 290.16 g/mol, XLogP of 4.10, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-1-methoxy-9-methylcarbazole is sourced from PubChem (CID 171449091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).