9-[(4-tert-butylphenyl)methyl]carbazole

C23H23N — CID 154964214

IUPAC9-[(4-tert-butylphenyl)methyl]carbazole
SMILESCC(C)(C)c1ccc(Cn2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C23H23N/c1-23(2,3)18-14-12-17(13-15-18)16-24-21-10-6-4-8-19(21)20-9-5-7-11-22(20)24/h4-15H,16H2,1-3H3
InChIKeyMOHATKOTPWAUPI-UHFFFAOYSA-N
MW313.44 g/mol
LogP6.14
Rot. Bonds2

About 9-[(4-tert-butylphenyl)methyl]carbazole

9-[(4-tert-butylphenyl)methyl]carbazole (PubChem CID 154964214) has the molecular formula C23H23N and a molecular weight of 313.44 g/mol. Its IUPAC name is 9-[(4-tert-butylphenyl)methyl]carbazole.

Molecular Properties

Compound Name9-[(4-tert-butylphenyl)methyl]carbazole
PubChem CID154964214
Molecular FormulaC23H23N
Molecular Weight313.44 g/mol
Exact Mass313.18
IUPAC Name9-[(4-tert-butylphenyl)methyl]carbazole
SMILESCC(C)(C)c1ccc(Cn2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C23H23N/c1-23(2,3)18-14-12-17(13-15-18)16-24-21-10-6-4-8-19(21)20-9-5-7-11-22(20)24/h4-15H,16H2,1-3H3
InChIKeyMOHATKOTPWAUPI-UHFFFAOYSA-N
XLogP6.14
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500313.44
LogP ≤ 56.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-[(4-chlorophenyl)methyl]carbazole
CID 15206746
3-[(4-tert-butylphenyl)methyl]-1H-benzimidazol-2-one
CID 755579
9-[[3-(carbazol-9-ylmethyl)phenyl]methyl]carbazole
CID 67781407
9-[[4-(trifluoromethyl)phenyl]methyl]pyrido[3,4-b]indol-3-amine
CID 102259553
2-[1-[(4-tert-butylphenyl)methyl]-2-[4-(trifluoromethyl)phenyl]indol-3-yl]-2-oxoacetic acid
CID 150721720
9-[[6-[5-(carbazol-9-ylmethyl)-2-pyridinyl]-3-pyridinyl]methyl]carbazole
CID 118352521
1-[(4-tert-butylphenyl)methyl]-2-(2-phenylethyl)benzimidazole
CID 18878938
1-[(4-tert-butylphenyl)methyl]-2-(2-methylphenyl)benzimidazole
CID 17000629
methane;9-[(3-methylphenyl)methyl]carbazole
CID 159308792
3-[[1-[(4-tert-butylphenyl)methyl]benzimidazol-2-yl]methyl]-1,2-benzoxazole
CID 16681098
9-[(4-chlorophenyl)methyl]pyrido[3,4-b]indole
CID 141321459
1-[(4-tert-butylphenyl)methyl]-2-(pyrrolidin-1-ylmethyl)benzimidazole
CID 18884998

Frequently Asked Questions

What is the IUPAC name of 9-[(4-tert-butylphenyl)methyl]carbazole?
The IUPAC name of 9-[(4-tert-butylphenyl)methyl]carbazole (CID 154964214) is 9-[(4-tert-butylphenyl)methyl]carbazole.
What is the SMILES notation for 9-[(4-tert-butylphenyl)methyl]carbazole?
The canonical SMILES for 9-[(4-tert-butylphenyl)methyl]carbazole is CC(C)(C)c1ccc(Cn2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of 9-[(4-tert-butylphenyl)methyl]carbazole?
The InChIKey is MOHATKOTPWAUPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N/c1-23(2,3)18-14-12-17(13-15-18)16-24-21-10-6-4-8-19(21)20-9-5-7-11-22(20)24/h4-15H,16H2,1-3H3.
What are the key properties of 9-[(4-tert-butylphenyl)methyl]carbazole?
9-[(4-tert-butylphenyl)methyl]carbazole has a molecular weight of 313.44 g/mol, XLogP of 6.14, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(4-tert-butylphenyl)methyl]carbazole is sourced from PubChem (CID 154964214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).