9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide

C24H24N2O2 — CID 174400974

IUPAC9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide
SMILESCOCc1ccc2c3c(C(N)=O)cccc3n(Cc3cc(C)ccc3C)c2c1
InChIInChI=1S/C24H24N2O2/c1-15-7-8-16(2)18(11-15)13-26-21-6-4-5-20(24(25)27)23(21)19-10-9-17(14-28-3)12-22(19)26/h4-12H,13-14H2,1-3H3,(H2,25,27)
InChIKeyCRXIPJSSQRDRIK-UHFFFAOYSA-N
MW372.47 g/mol
LogP4.70
Rot. Bonds5

About 9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide

9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide (PubChem CID 174400974) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is 9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide.

Molecular Properties

Compound Name9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide
PubChem CID174400974
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide
SMILESCOCc1ccc2c3c(C(N)=O)cccc3n(Cc3cc(C)ccc3C)c2c1
InChIInChI=1S/C24H24N2O2/c1-15-7-8-16(2)18(11-15)13-26-21-6-4-5-20(24(25)27)23(21)19-10-9-17(14-28-3)12-22(19)26/h4-12H,13-14H2,1-3H3,(H2,25,27)
InChIKeyCRXIPJSSQRDRIK-UHFFFAOYSA-N
XLogP4.70
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-[(2,5-dimethylphenyl)methyl]-7-propylcarbazole-4-carboxamide
CID 174440690
9-[(2-fluoro-3-methylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide
CID 174414098
9-[(2,3-dichlorophenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide
CID 174414684
9-(furan-3-ylmethyl)-7-(methoxymethyl)carbazole-4-carboxamide
CID 174444274
9-[(2-bromo-5-fluorophenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide
CID 174417849
7-ethyl-9-[(2-methylphenyl)methyl]carbazole-4-carboxamide
CID 174417581
9-[(2,4-dimethylphenyl)methyl]-7-pentylcarbazole-4-carboxamide
CID 174414828
9-[(2-fluoro-3-methylphenyl)methyl]-7-methylcarbazole-4-carboxamide
CID 174400303
9-[(2-chloro-6-fluorophenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide
CID 174400045
9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide
CID 174423911
9-[(2,4-dimethylphenyl)methyl]-7-phenylcarbazole-4-carboxamide
CID 175235829
9-[(4-ethoxyphenyl)methyl]-7-methylcarbazole-4-carboxamide
CID 174401373

Frequently Asked Questions

What is the IUPAC name of 9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide?
The IUPAC name of 9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide (CID 174400974) is 9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide.
What is the SMILES notation for 9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide?
The canonical SMILES for 9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide is COCc1ccc2c3c(C(N)=O)cccc3n(Cc3cc(C)ccc3C)c2c1.
What is the InChIKey of 9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide?
The InChIKey is CRXIPJSSQRDRIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2/c1-15-7-8-16(2)18(11-15)13-26-21-6-4-5-20(24(25)27)23(21)19-10-9-17(14-28-3)12-22(19)26/h4-12H,13-14H2,1-3H3,(H2,25,27).
What are the key properties of 9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide?
9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide has a molecular weight of 372.47 g/mol, XLogP of 4.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide is sourced from PubChem (CID 174400974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).