3-chloro-1,6-dimethoxy-9H-carbazole

C14H12ClNO2 — CID 171714846

IUPAC3-chloro-1,6-dimethoxy-9H-carbazole
SMILESCOc1ccc2[nH]c3c(OC)cc(Cl)cc3c2c1
InChIInChI=1S/C14H12ClNO2/c1-17-9-3-4-12-10(7-9)11-5-8(15)6-13(18-2)14(11)16-12/h3-7,16H,1-2H3
InChIKeyVIXUMRIAPVEMGV-UHFFFAOYSA-N
MW261.71 g/mol
LogP3.99
Rot. Bonds2

About 3-chloro-1,6-dimethoxy-9H-carbazole

3-chloro-1,6-dimethoxy-9H-carbazole (PubChem CID 171714846) has the molecular formula C14H12ClNO2 and a molecular weight of 261.71 g/mol. Its IUPAC name is 3-chloro-1,6-dimethoxy-9H-carbazole.

Molecular Properties

Compound Name3-chloro-1,6-dimethoxy-9H-carbazole
PubChem CID171714846
Molecular FormulaC14H12ClNO2
Molecular Weight261.71 g/mol
Exact Mass261.06
IUPAC Name3-chloro-1,6-dimethoxy-9H-carbazole
SMILESCOc1ccc2[nH]c3c(OC)cc(Cl)cc3c2c1
InChIInChI=1S/C14H12ClNO2/c1-17-9-3-4-12-10(7-9)11-5-8(15)6-13(18-2)14(11)16-12/h3-7,16H,1-2H3
InChIKeyVIXUMRIAPVEMGV-UHFFFAOYSA-N
XLogP3.99
TPSA34.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.71
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-8-methoxy-11,12-dihydroindolo[2,3-a]carbazole
CID 10758096
1,3-dimethoxy-6-methyl-9H-carbazole
CID 171714907
3-chloro-1,5,6,7-tetramethoxy-9H-carbazole
CID 171714852
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
6-chloro-3-methoxy-2-methyl-1-phenyl-9H-carbazole
CID 10947217
6-methoxy-9H-carbazol-3-ol
CID 142959347
3-fluoro-6-methoxy-9H-carbazole
CID 171714917
3,4-dichloro-6-methoxy-1H-quinolin-2-one
CID 110272519
7,19-dimethoxy-13-methyl-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4(9),5,7,10,15,17(22),18,20-nonaene-12,14-dione
CID 21216832
6-chloro-8-methoxy-1H-3,1-benzoxazine-2,4-dione
CID 86670580
9-methoxy-5-methyl-6H-pyrido[4,3-b]carbazole
CID 3047245
5-chloro-3-cyclopropyl-2-(4-methoxyphenyl)-1H-indole
CID 143870441

Frequently Asked Questions

What is the IUPAC name of 3-chloro-1,6-dimethoxy-9H-carbazole?
The IUPAC name of 3-chloro-1,6-dimethoxy-9H-carbazole (CID 171714846) is 3-chloro-1,6-dimethoxy-9H-carbazole.
What is the SMILES notation for 3-chloro-1,6-dimethoxy-9H-carbazole?
The canonical SMILES for 3-chloro-1,6-dimethoxy-9H-carbazole is COc1ccc2[nH]c3c(OC)cc(Cl)cc3c2c1.
What is the InChIKey of 3-chloro-1,6-dimethoxy-9H-carbazole?
The InChIKey is VIXUMRIAPVEMGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClNO2/c1-17-9-3-4-12-10(7-9)11-5-8(15)6-13(18-2)14(11)16-12/h3-7,16H,1-2H3.
What are the key properties of 3-chloro-1,6-dimethoxy-9H-carbazole?
3-chloro-1,6-dimethoxy-9H-carbazole has a molecular weight of 261.71 g/mol, XLogP of 3.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-1,6-dimethoxy-9H-carbazole is sourced from PubChem (CID 171714846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).