N-(carbazol-9-ylmethyl)-4-fluoroaniline

C19H15FN2 — CID 4987600

IUPACN-(carbazol-9-ylmethyl)-4-fluoroaniline
SMILESFc1ccc(NCn2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C19H15FN2/c20-14-9-11-15(12-10-14)21-13-22-18-7-3-1-5-16(18)17-6-2-4-8-19(17)22/h1-12,21H,13H2
InChIKeyHQQFJTLJXBLUAR-UHFFFAOYSA-N
MW290.34 g/mol
LogP5.00
Rot. Bonds3

About N-(carbazol-9-ylmethyl)-4-fluoroaniline

N-(carbazol-9-ylmethyl)-4-fluoroaniline (PubChem CID 4987600) has the molecular formula C19H15FN2 and a molecular weight of 290.34 g/mol. Its IUPAC name is N-(carbazol-9-ylmethyl)-4-fluoroaniline.

Molecular Properties

Compound NameN-(carbazol-9-ylmethyl)-4-fluoroaniline
PubChem CID4987600
Molecular FormulaC19H15FN2
Molecular Weight290.34 g/mol
Exact Mass290.12
IUPAC NameN-(carbazol-9-ylmethyl)-4-fluoroaniline
SMILESFc1ccc(NCn2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C19H15FN2/c20-14-9-11-15(12-10-14)21-13-22-18-7-3-1-5-16(18)17-6-2-4-8-19(17)22/h1-12,21H,13H2
InChIKeyHQQFJTLJXBLUAR-UHFFFAOYSA-N
XLogP5.00
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.34
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 162535518
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2-(3-fluorocarbazol-9-yl)ethanol
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2-[[9-(2-hydroxyethyl)carbazol-2-yl]amino]ethanol
CID 68826331
N-[2-(benzotriazol-1-yl)ethyl]-4-fluoroaniline
CID 55087842
9-ethyl-N-[(2-fluorophenyl)methyl]carbazol-3-amine
CID 22664102
(E)-N-(9-ethylcarbazol-3-yl)-3-(4-fluorophenyl)prop-2-enamide
CID 17164828
carbazol-9-ylmethylphosphane
CID 90324544
2-(2,4-dioxo-3-pentylquinazolin-1-yl)-N-(4-fluorophenyl)acetamide
CID 46860909
1-carbazol-9-yl-N,N-difluoromethanamine
CID 145129490
N-(4-fluorophenyl)-1-heptyl-4-hydroxy-2-oxoquinoline-3-carboxamide
CID 54680778
N-(9-ethylcarbazol-3-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 46920240

Frequently Asked Questions

What is the IUPAC name of N-(carbazol-9-ylmethyl)-4-fluoroaniline?
The IUPAC name of N-(carbazol-9-ylmethyl)-4-fluoroaniline (CID 4987600) is N-(carbazol-9-ylmethyl)-4-fluoroaniline.
What is the SMILES notation for N-(carbazol-9-ylmethyl)-4-fluoroaniline?
The canonical SMILES for N-(carbazol-9-ylmethyl)-4-fluoroaniline is Fc1ccc(NCn2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of N-(carbazol-9-ylmethyl)-4-fluoroaniline?
The InChIKey is HQQFJTLJXBLUAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2/c20-14-9-11-15(12-10-14)21-13-22-18-7-3-1-5-16(18)17-6-2-4-8-19(17)22/h1-12,21H,13H2.
What are the key properties of N-(carbazol-9-ylmethyl)-4-fluoroaniline?
N-(carbazol-9-ylmethyl)-4-fluoroaniline has a molecular weight of 290.34 g/mol, XLogP of 5.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(carbazol-9-ylmethyl)-4-fluoroaniline is sourced from PubChem (CID 4987600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).