1,8-dichloro-3,6-dimethyl-9H-carbazole

C14H11Cl2N — CID 156769034

IUPAC1,8-dichloro-3,6-dimethyl-9H-carbazole
SMILESCc1cc(Cl)c2[nH]c3c(Cl)cc(C)cc3c2c1
InChIInChI=1S/C14H11Cl2N/c1-7-3-9-10-4-8(2)6-12(16)14(10)17-13(9)11(15)5-7/h3-6,17H,1-2H3
InChIKeyWKBLJOYXHLHXEG-UHFFFAOYSA-N
MW264.16 g/mol
LogP5.24
Rot. Bonds

About 1,8-dichloro-3,6-dimethyl-9H-carbazole

1,8-dichloro-3,6-dimethyl-9H-carbazole (PubChem CID 156769034) has the molecular formula C14H11Cl2N and a molecular weight of 264.16 g/mol. Its IUPAC name is 1,8-dichloro-3,6-dimethyl-9H-carbazole.

Molecular Properties

Compound Name1,8-dichloro-3,6-dimethyl-9H-carbazole
PubChem CID156769034
Molecular FormulaC14H11Cl2N
Molecular Weight264.16 g/mol
Exact Mass263.03
IUPAC Name1,8-dichloro-3,6-dimethyl-9H-carbazole
SMILESCc1cc(Cl)c2[nH]c3c(Cl)cc(C)cc3c2c1
InChIInChI=1S/C14H11Cl2N/c1-7-3-9-10-4-8(2)6-12(16)14(10)17-13(9)11(15)5-7/h3-6,17H,1-2H3
InChIKeyWKBLJOYXHLHXEG-UHFFFAOYSA-N
XLogP5.24
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.16
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

1-chloro-3,6-dimethyl-9H-carbazole
CID 174314278
8-chloro-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
CID 19418954
2,3-dichloro-5-methyl-1H-pyrrole
CID 18918860
2,6-dichloro-4-methylaniline;ethane
CID 143233725
(7-chloro-5-methyl-1H-indol-3-yl) 2,2-dimethylpropanoate
CID 174468131
3,6,8-trichloro-2-methyl-1H-quinolin-4-one
CID 121236859
8-chloro-6-methyl-4-oxo-1H-quinoline-3-carbohydrazide
CID 121237264
2-(7-chloro-5-methyl-1H-indol-3-yl)cyclohexan-1-amine
CID 54405033
1,3,6-trimethyl-9H-carbazole
CID 139213984
1,6-dibromo-3-methyl-9H-carbazole
CID 171793156
7-chloro-3-ethyl-5-methyl-2H-indazole
CID 89021099
5,7-dichloro-2-methyl-1H-indole-3-carbaldehyde
CID 65335092

Frequently Asked Questions

What is the IUPAC name of 1,8-dichloro-3,6-dimethyl-9H-carbazole?
The IUPAC name of 1,8-dichloro-3,6-dimethyl-9H-carbazole (CID 156769034) is 1,8-dichloro-3,6-dimethyl-9H-carbazole.
What is the SMILES notation for 1,8-dichloro-3,6-dimethyl-9H-carbazole?
The canonical SMILES for 1,8-dichloro-3,6-dimethyl-9H-carbazole is Cc1cc(Cl)c2[nH]c3c(Cl)cc(C)cc3c2c1.
What is the InChIKey of 1,8-dichloro-3,6-dimethyl-9H-carbazole?
The InChIKey is WKBLJOYXHLHXEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N/c1-7-3-9-10-4-8(2)6-12(16)14(10)17-13(9)11(15)5-7/h3-6,17H,1-2H3.
What are the key properties of 1,8-dichloro-3,6-dimethyl-9H-carbazole?
1,8-dichloro-3,6-dimethyl-9H-carbazole has a molecular weight of 264.16 g/mol, XLogP of 5.24, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-dichloro-3,6-dimethyl-9H-carbazole is sourced from PubChem (CID 156769034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).