N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide

C21H17FN2O — CID 3128405

IUPACN-(9-ethylcarbazol-3-yl)-2-fluorobenzamide
SMILESCCn1c2ccccc2c2cc(NC(=O)c3ccccc3F)ccc21
InChIInChI=1S/C21H17FN2O/c1-2-24-19-10-6-4-7-15(19)17-13-14(11-12-20(17)24)23-21(25)16-8-3-5-9-18(16)22/h3-13H,2H2,1H3,(H,23,25)
InChIKeyLZCHIKQBDGDBHF-UHFFFAOYSA-N
MW332.38 g/mol
LogP5.21
Rot. Bonds3

About N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide

N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide (PubChem CID 3128405) has the molecular formula C21H17FN2O and a molecular weight of 332.38 g/mol. Its IUPAC name is N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide.

Molecular Properties

Compound NameN-(9-ethylcarbazol-3-yl)-2-fluorobenzamide
PubChem CID3128405
Molecular FormulaC21H17FN2O
Molecular Weight332.38 g/mol
Exact Mass332.13
IUPAC NameN-(9-ethylcarbazol-3-yl)-2-fluorobenzamide
SMILESCCn1c2ccccc2c2cc(NC(=O)c3ccccc3F)ccc21
InChIInChI=1S/C21H17FN2O/c1-2-24-19-10-6-4-7-15(19)17-13-14(11-12-20(17)24)23-21(25)16-8-3-5-9-18(16)22/h3-13H,2H2,1H3,(H,23,25)
InChIKeyLZCHIKQBDGDBHF-UHFFFAOYSA-N
XLogP5.21
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.38
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-5-[(2-fluorobenzoyl)amino]indole-2-carboxamide
CID 83282725
N-(9-ethylcarbazol-3-yl)-1-methylpyrrole-2-carboxamide
CID 10267869
N-(9-ethylcarbazol-3-yl)-2-sulfanylacetamide
CID 54424608
N-(9-ethylcarbazol-3-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 46920240
N-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl]-3,4-difluorobenzamide
CID 60550642
2-(2-amino-2-oxoethyl)sulfanyl-N-(9-ethylcarbazol-3-yl)pyridine-3-carboxamide
CID 9400408
5-bromo-N-(9-ethylcarbazol-3-yl)thiophene-2-carboxamide
CID 2313809
trans-(1S,2S)-1-N,2-N-bis(9-ethylcarbazol-3-yl)-3-methylidenecyclopropane-1,2-dicarboxamide
CID 2321929
2-ethyl-N-(9-ethylcarbazol-3-yl)-5-methylpyrazole-3-carboxamide
CID 60619206
N-(9-ethylcarbazol-3-yl)-1-methyl-2-oxopyridine-4-carboxamide
CID 35740949
N-(9-ethylcarbazol-3-yl)-2-pyridin-4-ylquinoline-4-carboxamide
CID 2330776
phenyl N-(9-ethylcarbazol-3-yl)carbamate
CID 2182675

Frequently Asked Questions

What is the IUPAC name of N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide?
The IUPAC name of N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide (CID 3128405) is N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide.
What is the SMILES notation for N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide?
The canonical SMILES for N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide is CCn1c2ccccc2c2cc(NC(=O)c3ccccc3F)ccc21.
What is the InChIKey of N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide?
The InChIKey is LZCHIKQBDGDBHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN2O/c1-2-24-19-10-6-4-7-15(19)17-13-14(11-12-20(17)24)23-21(25)16-8-3-5-9-18(16)22/h3-13H,2H2,1H3,(H,23,25).
What are the key properties of N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide?
N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide has a molecular weight of 332.38 g/mol, XLogP of 5.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-ethylcarbazol-3-yl)-2-fluorobenzamide is sourced from PubChem (CID 3128405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).