N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride

C17H13ClFN3 — CID 14536473

IUPACN-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride
SMILESCl.Fc1cnccc1Nn1c2ccccc2c2ccccc21
InChIInChI=1S/C17H12FN3.ClH/c18-14-11-19-10-9-15(14)20-21-16-7-3-1-5-12(16)13-6-2-4-8-17(13)21;/h1-11H,(H,19,20);1H
InChIKeyHSASMDWJIJEZFV-UHFFFAOYSA-N
MW313.76 g/mol
LogP4.63
Rot. Bonds2

About N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride

N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride (PubChem CID 14536473) has the molecular formula C17H13ClFN3 and a molecular weight of 313.76 g/mol. Its IUPAC name is N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride.

Molecular Properties

Compound NameN-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride
PubChem CID14536473
Molecular FormulaC17H13ClFN3
Molecular Weight313.76 g/mol
Exact Mass313.08
IUPAC NameN-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride
SMILESCl.Fc1cnccc1Nn1c2ccccc2c2ccccc21
InChIInChI=1S/C17H12FN3.ClH/c18-14-11-19-10-9-15(14)20-21-16-7-3-1-5-12(16)13-6-2-4-8-17(13)21;/h1-11H,(H,19,20);1H
InChIKeyHSASMDWJIJEZFV-UHFFFAOYSA-N
XLogP4.63
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.76
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride?
The IUPAC name of N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride (CID 14536473) is N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride.
What is the SMILES notation for N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride?
The canonical SMILES for N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride is Cl.Fc1cnccc1Nn1c2ccccc2c2ccccc21.
What is the InChIKey of N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride?
The InChIKey is HSASMDWJIJEZFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FN3.ClH/c18-14-11-19-10-9-15(14)20-21-16-7-3-1-5-12(16)13-6-2-4-8-17(13)21;/h1-11H,(H,19,20);1H.
What are the key properties of N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride?
N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride has a molecular weight of 313.76 g/mol, XLogP of 4.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-pyridinyl)carbazol-9-amine;hydrochloride is sourced from PubChem (CID 14536473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).