N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide

C24H23FN2O2 — CID 17166239

IUPACN-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide
SMILESCCC(Oc1ccc(F)cc1)C(=O)Nc1ccc2c(c1)c1ccccc1n2CC
InChIInChI=1S/C24H23FN2O2/c1-3-23(29-18-12-9-16(25)10-13-18)24(28)26-17-11-14-22-20(15-17)19-7-5-6-8-21(19)27(22)4-2/h5-15,23H,3-4H2,1-2H3,(H,26,28)
InChIKeyRNYMZMBDQXDXRS-UHFFFAOYSA-N
MW390.46 g/mol
LogP5.75
Rot. Bonds6

About N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide

N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide (PubChem CID 17166239) has the molecular formula C24H23FN2O2 and a molecular weight of 390.46 g/mol. Its IUPAC name is N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide.

Molecular Properties

Compound NameN-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide
PubChem CID17166239
Molecular FormulaC24H23FN2O2
Molecular Weight390.46 g/mol
Exact Mass390.17
IUPAC NameN-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide
SMILESCCC(Oc1ccc(F)cc1)C(=O)Nc1ccc2c(c1)c1ccccc1n2CC
InChIInChI=1S/C24H23FN2O2/c1-3-23(29-18-12-9-16(25)10-13-18)24(28)26-17-11-14-22-20(15-17)19-7-5-6-8-21(19)27(22)4-2/h5-15,23H,3-4H2,1-2H3,(H,26,28)
InChIKeyRNYMZMBDQXDXRS-UHFFFAOYSA-N
XLogP5.75
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.46
LogP ≤ 55.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(3,5-dimethylphenoxy)-N-(9-ethylcarbazol-3-yl)butanamide
CID 28988595
N-(9-ethylcarbazol-3-yl)-2-(3-methylphenoxy)butanamide
CID 43905053
(2R)-N-(3-ethyl-2-oxo-1,3-benzothiazol-6-yl)-2-(4-fluorophenoxy)butanamide
CID 100544474
(2R)-N-(9-ethylcarbazol-3-yl)-2-(4-methylphenoxy)propanamide
CID 1019882
2-(4-bromophenoxy)-N-(9-ethylcarbazol-3-yl)propanamide
CID 18837985
2-(4-fluorophenoxy)-N-(3-propan-2-yloxyphenyl)butanamide
CID 43876065
2-(4-fluorophenoxy)-N-(3-methylphenyl)butanamide
CID 53284409
(2S)-N-(3-bromophenyl)-2-(4-fluorophenoxy)butanamide
CID 92679949
(2S)-2-(4-fluorophenoxy)-N-(4-propan-2-ylphenyl)butanamide
CID 99131421
2-(4-chlorophenoxy)-N-(4-fluorophenyl)butanamide
CID 53285318
(2S)-2-(4-fluorophenoxy)-N-[3-(trifluoromethyl)phenyl]butanamide
CID 28578484
(2S)-N-(3,5-dichlorophenyl)-2-(4-fluorophenoxy)butanamide
CID 94020016

Frequently Asked Questions

What is the IUPAC name of N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide?
The IUPAC name of N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide (CID 17166239) is N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide.
What is the SMILES notation for N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide?
The canonical SMILES for N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide is CCC(Oc1ccc(F)cc1)C(=O)Nc1ccc2c(c1)c1ccccc1n2CC.
What is the InChIKey of N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide?
The InChIKey is RNYMZMBDQXDXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN2O2/c1-3-23(29-18-12-9-16(25)10-13-18)24(28)26-17-11-14-22-20(15-17)19-7-5-6-8-21(19)27(22)4-2/h5-15,23H,3-4H2,1-2H3,(H,26,28).
What are the key properties of N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide?
N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide has a molecular weight of 390.46 g/mol, XLogP of 5.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-ethylcarbazol-3-yl)-2-(4-fluorophenoxy)butanamide is sourced from PubChem (CID 17166239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).