1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole

C27H22N2O2 — CID 14634645

IUPAC1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole
SMILESCOc1cc(-n2c3ccccc3c3cc(C)cc(OC)c32)cc2c1[nH]c1ccccc12
InChIInChI=1S/C27H22N2O2/c1-16-12-21-19-9-5-7-11-23(19)29(27(21)25(13-16)31-3)17-14-20-18-8-4-6-10-22(18)28-26(20)24(15-17)30-2/h4-15,28H,1-3H3
InChIKeyYMKKERLGXGTYBK-UHFFFAOYSA-N
MW406.49 g/mol
LogP6.74
Rot. Bonds3

About 1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole

1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole (PubChem CID 14634645) has the molecular formula C27H22N2O2 and a molecular weight of 406.49 g/mol. Its IUPAC name is 1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole.

Molecular Properties

Compound Name1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole
PubChem CID14634645
Molecular FormulaC27H22N2O2
Molecular Weight406.49 g/mol
Exact Mass406.17
IUPAC Name1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole
SMILESCOc1cc(-n2c3ccccc3c3cc(C)cc(OC)c32)cc2c1[nH]c1ccccc12
InChIInChI=1S/C27H22N2O2/c1-16-12-21-19-9-5-7-11-23(19)29(27(21)25(13-16)31-3)17-14-20-18-8-4-6-10-22(18)28-26(20)24(15-17)30-2/h4-15,28H,1-3H3
InChIKeyYMKKERLGXGTYBK-UHFFFAOYSA-N
XLogP6.74
TPSA39.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.49
LogP ≤ 56.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methoxy-9-[(1-methoxy-9H-carbazol-3-yl)methyl]-3-[(1-methoxy-3-methylcarbazol-9-yl)methyl]carbazole
CID 102015823
(1S)-1-(1-methoxy-3-methylcarbazol-9-yl)-3,3,5-trimethyl-2,11-dihydro-1H-pyrano[3,2-a]carbazole
CID 163076406
3-carbazol-9-yl-9-[9-[9-[9-[9-[9-(9H-carbazol-3-yl)carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazole
CID 25208834
3-methyl-1-(3-methylbut-2-enoxy)-9H-carbazole
CID 91493313
3,19-bis(3,4,5-trimethoxyphenyl)-11-thia-3,19-diazapentacyclo[10.7.0.02,10.04,9.013,18]nonadeca-1(12),2(10),4,6,8,13,15,17-octaene
CID 71483633
ethane;3-methyl-9H-carbazole;9-(3-methylphenyl)carbazole
CID 167454384
1,2-dimethoxy-3-methyl-9H-carbazole
CID 121392171
1,3-dimethoxy-6-methyl-9H-carbazole
CID 171714907
9-(4-methoxy-3-methylphenyl)carbazole
CID 123263488
12-[4-(3-phenylphenyl)phenyl]-11H-indolo[2,3-a]carbazole
CID 165165620
6,12-diphenyl-5H-indolo[3,2-c]carbazole
CID 67494594
12-(4-bromophenyl)-11H-indolo[2,3-a]carbazole
CID 135315039

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole?
The IUPAC name of 1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole (CID 14634645) is 1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole.
What is the SMILES notation for 1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole?
The canonical SMILES for 1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole is COc1cc(-n2c3ccccc3c3cc(C)cc(OC)c32)cc2c1[nH]c1ccccc12.
What is the InChIKey of 1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole?
The InChIKey is YMKKERLGXGTYBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22N2O2/c1-16-12-21-19-9-5-7-11-23(19)29(27(21)25(13-16)31-3)17-14-20-18-8-4-6-10-22(18)28-26(20)24(15-17)30-2/h4-15,28H,1-3H3.
What are the key properties of 1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole?
1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole has a molecular weight of 406.49 g/mol, XLogP of 6.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-9-(1-methoxy-9H-carbazol-3-yl)-3-methylcarbazole is sourced from PubChem (CID 14634645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).