N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine

C16H19FN2 — CID 55163375

IUPACN-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine
SMILESCCCNC(Cc1ccc(F)cn1)c1ccccc1
InChIInChI=1S/C16H19FN2/c1-2-10-18-16(13-6-4-3-5-7-13)11-15-9-8-14(17)12-19-15/h3-9,12,16,18H,2,10-11H2,1H3
InChIKeyUOTJWAZFWZJLSS-UHFFFAOYSA-N
MW258.34 g/mol
LogP3.50
Rot. Bonds6

About N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine

N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine (PubChem CID 55163375) has the molecular formula C16H19FN2 and a molecular weight of 258.34 g/mol. Its IUPAC name is N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine
PubChem CID55163375
Molecular FormulaC16H19FN2
Molecular Weight258.34 g/mol
Exact Mass258.15
IUPAC NameN-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine
SMILESCCCNC(Cc1ccc(F)cn1)c1ccccc1
InChIInChI=1S/C16H19FN2/c1-2-10-18-16(13-6-4-3-5-7-13)11-15-9-8-14(17)12-19-15/h3-9,12,16,18H,2,10-11H2,1H3
InChIKeyUOTJWAZFWZJLSS-UHFFFAOYSA-N
XLogP3.50
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(5-chloro-2-pyridinyl)-1-phenylethyl]propan-1-amine
CID 63199678
N-(1-phenyl-2-pyrimidin-2-ylethyl)propan-1-amine
CID 55163177
N-[(1S)-1,2-diphenylethyl]propan-1-amine
CID 36689865
N-[2-(2-bromo-4-fluorophenyl)-1-phenylethyl]propan-1-amine
CID 63413016
N-[2-(5-ethyl-2-pyridinyl)-1-(4-methylphenyl)ethyl]propan-1-amine
CID 79732889
N-[1-(4-iodophenyl)-2-(5-methyl-2-pyridinyl)ethyl]propan-1-amine
CID 66448862
N-[2-(5-bromo-2-pyridinyl)-1-(2-fluorophenyl)ethyl]propan-1-amine
CID 104801976
N-[2-(5-bromo-2-pyridinyl)-1-pyridin-3-ylethyl]propan-1-amine
CID 104801238
5-fluoro-N-(1-phenylpropyl)pyridin-2-amine
CID 62305917
N-[1-(2-bromo-4-fluorophenyl)-2-(5-bromo-2-pyridinyl)ethyl]propan-1-amine
CID 105036047
N-[1-(2-bromo-4-fluorophenyl)-2-(5-methyl-2-pyridinyl)ethyl]propan-1-amine
CID 66446354
N-[2-(5-bromo-2-pyridinyl)-1-(4-methoxyphenyl)ethyl]propan-1-amine
CID 104800981

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine?
The IUPAC name of N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine (CID 55163375) is N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine.
What is the SMILES notation for N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine?
The canonical SMILES for N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine is CCCNC(Cc1ccc(F)cn1)c1ccccc1.
What is the InChIKey of N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine?
The InChIKey is UOTJWAZFWZJLSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2/c1-2-10-18-16(13-6-4-3-5-7-13)11-15-9-8-14(17)12-19-15/h3-9,12,16,18H,2,10-11H2,1H3.
What are the key properties of N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine?
N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine has a molecular weight of 258.34 g/mol, XLogP of 3.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-fluoro-2-pyridinyl)-1-phenylethyl]propan-1-amine is sourced from PubChem (CID 55163375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).