1,3,6-trichloro-2-methoxy-9-methylcarbazole

C14H10Cl3NO — CID 10543317

IUPAC1,3,6-trichloro-2-methoxy-9-methylcarbazole
SMILESCOc1c(Cl)cc2c3cc(Cl)ccc3n(C)c2c1Cl
InChIInChI=1S/C14H10Cl3NO/c1-18-11-4-3-7(15)5-8(11)9-6-10(16)14(19-2)12(17)13(9)18/h3-6H,1-2H3
InChIKeyZXSLAAJAICPZNV-UHFFFAOYSA-N
MW314.60 g/mol
LogP5.30
Rot. Bonds1

About 1,3,6-trichloro-2-methoxy-9-methylcarbazole

1,3,6-trichloro-2-methoxy-9-methylcarbazole (PubChem CID 10543317) has the molecular formula C14H10Cl3NO and a molecular weight of 314.60 g/mol. Its IUPAC name is 1,3,6-trichloro-2-methoxy-9-methylcarbazole.

Molecular Properties

Compound Name1,3,6-trichloro-2-methoxy-9-methylcarbazole
PubChem CID10543317
Molecular FormulaC14H10Cl3NO
Molecular Weight314.60 g/mol
Exact Mass312.98
IUPAC Name1,3,6-trichloro-2-methoxy-9-methylcarbazole
SMILESCOc1c(Cl)cc2c3cc(Cl)ccc3n(C)c2c1Cl
InChIInChI=1S/C14H10Cl3NO/c1-18-11-4-3-7(15)5-8(11)9-6-10(16)14(19-2)12(17)13(9)18/h3-6H,1-2H3
InChIKeyZXSLAAJAICPZNV-UHFFFAOYSA-N
XLogP5.30
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.60
LogP ≤ 55.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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6-chloro-1,4-dimethoxy-10-methylacridin-9-one
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10-chloro-5-methoxy-7-methylindolo[2,3-c]quinolin-6-one
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4-chloro-6-methoxy-1-methylquinolin-2-one
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1-chloro-2-methoxy-9-methylcarbazole
CID 10634135
methyl 5-chloro-2-(chloromethyl)-1-methylindole-3-carboxylate
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N-(6-chloro-3-methyl-1,3-benzothiazol-2-ylidene)-3,4,5-trimethoxybenzamide
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6-chloro-2-fluoro-3-methoxy-1-benzothiophene
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CID 21101818
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Frequently Asked Questions

What is the IUPAC name of 1,3,6-trichloro-2-methoxy-9-methylcarbazole?
The IUPAC name of 1,3,6-trichloro-2-methoxy-9-methylcarbazole (CID 10543317) is 1,3,6-trichloro-2-methoxy-9-methylcarbazole.
What is the SMILES notation for 1,3,6-trichloro-2-methoxy-9-methylcarbazole?
The canonical SMILES for 1,3,6-trichloro-2-methoxy-9-methylcarbazole is COc1c(Cl)cc2c3cc(Cl)ccc3n(C)c2c1Cl.
What is the InChIKey of 1,3,6-trichloro-2-methoxy-9-methylcarbazole?
The InChIKey is ZXSLAAJAICPZNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3NO/c1-18-11-4-3-7(15)5-8(11)9-6-10(16)14(19-2)12(17)13(9)18/h3-6H,1-2H3.
What are the key properties of 1,3,6-trichloro-2-methoxy-9-methylcarbazole?
1,3,6-trichloro-2-methoxy-9-methylcarbazole has a molecular weight of 314.60 g/mol, XLogP of 5.30, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,6-trichloro-2-methoxy-9-methylcarbazole is sourced from PubChem (CID 10543317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).