7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide

C22H19FN2O2 — CID 22740716

IUPAC7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide
SMILESCCc1cc(O)c2c3c(C(N)=O)cccc3n(Cc3ccccc3F)c2c1
InChIInChI=1S/C22H19FN2O2/c1-2-13-10-18-21(19(26)11-13)20-15(22(24)27)7-5-9-17(20)25(18)12-14-6-3-4-8-16(14)23/h3-11,26H,2,12H2,1H3,(H2,24,27)
InChIKeyQXFJOFKOXAQEPJ-UHFFFAOYSA-N
MW362.40 g/mol
LogP4.35
Rot. Bonds4

About 7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide

7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide (PubChem CID 22740716) has the molecular formula C22H19FN2O2 and a molecular weight of 362.40 g/mol. Its IUPAC name is 7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide.

Molecular Properties

Compound Name7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide
PubChem CID22740716
Molecular FormulaC22H19FN2O2
Molecular Weight362.40 g/mol
Exact Mass362.14
IUPAC Name7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide
SMILESCCc1cc(O)c2c3c(C(N)=O)cccc3n(Cc3ccccc3F)c2c1
InChIInChI=1S/C22H19FN2O2/c1-2-13-10-18-21(19(26)11-13)20-15(22(24)27)7-5-9-17(20)25(18)12-14-6-3-4-8-16(14)23/h3-11,26H,2,12H2,1H3,(H2,24,27)
InChIKeyQXFJOFKOXAQEPJ-UHFFFAOYSA-N
XLogP4.35
TPSA68.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.40
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(9-hydroxy-1,3-dioxo-4-phenyl-2,3-dihydropyrrolo[3,4-c]carbazol-6(1H)-yl)propanoic acid
CID 9978312
9-Hydroxy-6-(3-hydroxypropyl)-4-(2-methoxyphenyl)pyrrolo(3,4-C)carbazole-1,3(2H,6H)-dione
CID 10364585
1-[(3-carbamimidoylphenyl)methyl]-N-[(3,5-dimethylphenyl)methyl]-4-hydroxy-1H-indole-2-carboxamide
CID 10071127
N,1-bis[(3-carbamimidoylphenyl)methyl]-4-hydroxy-1H-indole-2-carboxamide
CID 11048452
9-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(2-hydroxypropan-2-yl)-9H-carbazole-4-carboxamide
CID 77461280
1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-{[3-methyl-5-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide
CID 10896126
1-[(3-carbamimidoylphenyl)methyl]-N-[(3-fluorophenyl)methyl]-4-hydroxy-1H-indole-2-carboxamide
CID 10927859
1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-[(3-methylphenyl)methyl]-1H-indole-2-carboxamide
CID 10949672
1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-(naphthalen-1-ylmethyl)-1H-indole-2-carboxamide
CID 10950398
1-[(3-carbamimidoylphenyl)methyl]-N-{[3-fluoro-5-(trifluoromethyl)phenyl]methyl}-4-hydroxy-1H-indole-2-carboxamide
CID 10972928
1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide
CID 11102680
1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-[2-(naphthalen-1-ylamino)ethyl]-1H-indole-2-carboxamide
CID 11113557

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide?
The IUPAC name of 7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide (CID 22740716) is 7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide.
What is the SMILES notation for 7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide?
The canonical SMILES for 7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide is CCc1cc(O)c2c3c(C(N)=O)cccc3n(Cc3ccccc3F)c2c1.
What is the InChIKey of 7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide?
The InChIKey is QXFJOFKOXAQEPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN2O2/c1-2-13-10-18-21(19(26)11-13)20-15(22(24)27)7-5-9-17(20)25(18)12-14-6-3-4-8-16(14)23/h3-11,26H,2,12H2,1H3,(H2,24,27).
What are the key properties of 7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide?
7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide has a molecular weight of 362.40 g/mol, XLogP of 4.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide is sourced from PubChem (CID 22740716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).