7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide

C22H19FN2O2 — CID 22738776

IUPAC7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide
SMILESCCc1cc(O)c2c3c(C(N)=O)cccc3n(Cc3cccc(F)c3)c2c1
InChIInChI=1S/C22H19FN2O2/c1-2-13-10-18-21(19(26)11-13)20-16(22(24)27)7-4-8-17(20)25(18)12-14-5-3-6-15(23)9-14/h3-11,26H,2,12H2,1H3,(H2,24,27)
InChIKeyDNROZEIAMBKHTB-UHFFFAOYSA-N
MW362.40 g/mol
LogP4.35
Rot. Bonds4

About 7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide

7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide (PubChem CID 22738776) has the molecular formula C22H19FN2O2 and a molecular weight of 362.40 g/mol. Its IUPAC name is 7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide.

Molecular Properties

Compound Name7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide
PubChem CID22738776
Molecular FormulaC22H19FN2O2
Molecular Weight362.40 g/mol
Exact Mass362.14
IUPAC Name7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide
SMILESCCc1cc(O)c2c3c(C(N)=O)cccc3n(Cc3cccc(F)c3)c2c1
InChIInChI=1S/C22H19FN2O2/c1-2-13-10-18-21(19(26)11-13)20-16(22(24)27)7-4-8-17(20)25(18)12-14-5-3-6-15(23)9-14/h3-11,26H,2,12H2,1H3,(H2,24,27)
InChIKeyDNROZEIAMBKHTB-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

7-ethyl-5-hydroxy-9-[[3-(trifluoromethyl)phenyl]methyl]carbazole-4-carboxamide
CID 22738225
2-[5-carbamoyl-9-[(3-fluorophenyl)methyl]carbazol-4-yl]-2-oxoacetic acid
CID 54135436
methyl 9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxylate
CID 22738295
9-benzyl-5-hydroxy-7-methylcarbazole-4-carboxamide
CID 22739371
5-hydroxy-7-methyl-9-[[3-(trifluoromethyl)phenyl]methyl]carbazole-4-carboxamide
CID 22740787
5-hydroxy-7-pentyl-9-[(3-phenoxyphenyl)methyl]carbazole-4-carboxamide
CID 22740496
methyl 7-ethyl-9-[(2-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxylate
CID 22738994
9-[(3,5-dimethylphenyl)methyl]-5-hydroxycarbazole-4-carboxamide
CID 22739095
9-[(3-carbamoylphenyl)methyl]-7-ethylcarbazole-4-carboxamide
CID 174418283
9-[(3-bromophenyl)methyl]-6-fluorocarbazole-4-carboxamide
CID 174417549
9-ethyl-5-hydroxycarbazole-4-carboxamide
CID 59934183
2-[5-carbamoyl-9-[[3-(difluoromethoxy)phenyl]methyl]-2-ethylcarbazol-4-yl]peroxyacetic acid
CID 151981594

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide?
The IUPAC name of 7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide (CID 22738776) is 7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide.
What is the SMILES notation for 7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide?
The canonical SMILES for 7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide is CCc1cc(O)c2c3c(C(N)=O)cccc3n(Cc3cccc(F)c3)c2c1.
What is the InChIKey of 7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide?
The InChIKey is DNROZEIAMBKHTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN2O2/c1-2-13-10-18-21(19(26)11-13)20-16(22(24)27)7-4-8-17(20)25(18)12-14-5-3-6-15(23)9-14/h3-11,26H,2,12H2,1H3,(H2,24,27).
What are the key properties of 7-ethyl-9-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide?
7-ethyl-9-[(3-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-[(3-fluorophenyl)methyl]-5-hydroxycarbazole-4-carboxamide is sourced from PubChem (CID 22738776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).