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

C22H20N2O — CID 174423911

IUPAC9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide
SMILESCc1ccc(Cn2c3ccccc3c3c(C(N)=O)cccc32)c(C)c1
InChIInChI=1S/C22H20N2O/c1-14-10-11-16(15(2)12-14)13-24-19-8-4-3-6-17(19)21-18(22(23)25)7-5-9-20(21)24/h3-12H,13H2,1-2H3,(H2,23,25)
InChIKeyYMBBECCLFMWJPD-UHFFFAOYSA-N
MW328.42 g/mol
LogP4.56
Rot. Bonds3

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

9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide (PubChem CID 174423911) has the molecular formula C22H20N2O and a molecular weight of 328.42 g/mol. Its IUPAC name is 9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide.

Molecular Properties

Compound Name9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide
PubChem CID174423911
Molecular FormulaC22H20N2O
Molecular Weight328.42 g/mol
Exact Mass328.16
IUPAC Name9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide
SMILESCc1ccc(Cn2c3ccccc3c3c(C(N)=O)cccc32)c(C)c1
InChIInChI=1S/C22H20N2O/c1-14-10-11-16(15(2)12-14)13-24-19-8-4-3-6-17(19)21-18(22(23)25)7-5-9-20(21)24/h3-12H,13H2,1-2H3,(H2,23,25)
InChIKeyYMBBECCLFMWJPD-UHFFFAOYSA-N
XLogP4.56
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9-[(2,4-dimethylphenyl)methyl]-7-phenylcarbazole-4-carboxamide
CID 175235829
9-[(1-bromonaphthalen-2-yl)methyl]-7-methylcarbazole-4-carboxamide
CID 174399462
9-[(2,4-dimethylphenyl)methyl]-7-pentylcarbazole-4-carboxamide
CID 174414828
9-[(2-fluoro-3-methylphenyl)methyl]-7-methylcarbazole-4-carboxamide
CID 174400303
9-(naphthalen-1-ylmethyl)carbazole-4-carboxamide
CID 70088178
7-methyl-9-[[2-(trifluoromethyl)phenyl]methyl]carbazole-4-carboxamide
CID 174401716
9-[(2,3,4-trifluorophenyl)methyl]carbazole-4-carboxamide
CID 174400319
9-[(3-chloro-4-methylphenyl)methyl]carbazole-4-carboxamide
CID 174414833
9-[(2,5-dimethylphenyl)methyl]-7-propylcarbazole-4-carboxamide
CID 174440690
7-ethyl-9-[(2-methylphenyl)methyl]carbazole-4-carboxamide
CID 174417581
9-[(2,5-dimethylphenyl)methyl]-7-(methoxymethyl)carbazole-4-carboxamide
CID 174400974
9-[(4-methylphenyl)methyl]-7-phenylcarbazole-4-carboxamide
CID 174424042

Frequently Asked Questions

What is the IUPAC name of 9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide?
The IUPAC name of 9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide (CID 174423911) is 9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide.
What is the SMILES notation for 9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide?
The canonical SMILES for 9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide is Cc1ccc(Cn2c3ccccc3c3c(C(N)=O)cccc32)c(C)c1.
What is the InChIKey of 9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide?
The InChIKey is YMBBECCLFMWJPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O/c1-14-10-11-16(15(2)12-14)13-24-19-8-4-3-6-17(19)21-18(22(23)25)7-5-9-20(21)24/h3-12H,13H2,1-2H3,(H2,23,25).
What are the key properties of 9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide?
9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 4.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(2,4-dimethylphenyl)methyl]carbazole-4-carboxamide is sourced from PubChem (CID 174423911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).