7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide

C28H24N2O2 — CID 174401048

IUPAC7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide
SMILESCOc1ccc(-c2ccc3c4c(C(N)=O)cccc4n(Cc4ccc(C)cc4)c3c2)cc1
InChIInChI=1S/C28H24N2O2/c1-18-6-8-19(9-7-18)17-30-25-5-3-4-24(28(29)31)27(25)23-15-12-21(16-26(23)30)20-10-13-22(32-2)14-11-20/h3-16H,17H2,1-2H3,(H2,29,31)
InChIKeyOOQWUGAEWWXSDE-UHFFFAOYSA-N
MW420.51 g/mol
LogP5.93
Rot. Bonds5

About 7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide

7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide (PubChem CID 174401048) has the molecular formula C28H24N2O2 and a molecular weight of 420.51 g/mol. Its IUPAC name is 7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide.

Molecular Properties

Compound Name7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide
PubChem CID174401048
Molecular FormulaC28H24N2O2
Molecular Weight420.51 g/mol
Exact Mass420.18
IUPAC Name7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide
SMILESCOc1ccc(-c2ccc3c4c(C(N)=O)cccc4n(Cc4ccc(C)cc4)c3c2)cc1
InChIInChI=1S/C28H24N2O2/c1-18-6-8-19(9-7-18)17-30-25-5-3-4-24(28(29)31)27(25)23-15-12-21(16-26(23)30)20-10-13-22(32-2)14-11-20/h3-16H,17H2,1-2H3,(H2,29,31)
InChIKeyOOQWUGAEWWXSDE-UHFFFAOYSA-N
XLogP5.93
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.51
LogP ≤ 55.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-[(4-carbamoylphenyl)methyl]-7-(4-methoxyphenyl)carbazole-4-carboxamide
CID 174400022
9-[(4-methylphenyl)methyl]-7-phenylcarbazole-4-carboxamide
CID 174424042
9-[(2,6-dichlorophenyl)methyl]-7-(4-methoxyphenyl)carbazole-4-carboxamide
CID 175233547
9-[(2-ethylphenyl)methyl]-7-(4-methoxyphenyl)carbazole-4-carboxamide
CID 174418321
9-[(2-bromophenyl)methyl]-7-(4-methoxyphenyl)carbazole-4-carboxamide
CID 174414385
9-[(4-ethoxyphenyl)methyl]-7-methylcarbazole-4-carboxamide
CID 174401373
9-[(2-benzoylphenyl)methyl]-7-(4-methoxyphenyl)carbazole-4-carboxamide
CID 174414302
9-[(4-chlorophenyl)methyl]-7-phenylcarbazole-4-carboxamide
CID 174400985
9-[(4-bromophenyl)methyl]-7-(4-chlorophenyl)carbazole-4-carboxamide
CID 174414760
9-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-7-(4-methoxyphenyl)carbazole-4-carboxamide
CID 174414660
9-[(2,4-dimethylphenyl)methyl]-7-phenylcarbazole-4-carboxamide
CID 175235829
9-[(3-chloro-4-methoxyphenyl)methyl]-7-(2,6-dichlorophenyl)carbazole-4-carboxamide
CID 174401344

Frequently Asked Questions

What is the IUPAC name of 7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide?
The IUPAC name of 7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide (CID 174401048) is 7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide.
What is the SMILES notation for 7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide?
The canonical SMILES for 7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide is COc1ccc(-c2ccc3c4c(C(N)=O)cccc4n(Cc4ccc(C)cc4)c3c2)cc1.
What is the InChIKey of 7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide?
The InChIKey is OOQWUGAEWWXSDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N2O2/c1-18-6-8-19(9-7-18)17-30-25-5-3-4-24(28(29)31)27(25)23-15-12-21(16-26(23)30)20-10-13-22(32-2)14-11-20/h3-16H,17H2,1-2H3,(H2,29,31).
What are the key properties of 7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide?
7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide has a molecular weight of 420.51 g/mol, XLogP of 5.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-methoxyphenyl)-9-[(4-methylphenyl)methyl]carbazole-4-carboxamide is sourced from PubChem (CID 174401048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).