N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine

C14H15FN2 — CID 54967779

IUPACN-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine
SMILESCCNC(c1ccccc1)c1cncc(F)c1
InChIInChI=1S/C14H15FN2/c1-2-17-14(11-6-4-3-5-7-11)12-8-13(15)10-16-9-12/h3-10,14,17H,2H2,1H3
InChIKeyQAZCHFDMFYFNCD-UHFFFAOYSA-N
MW230.29 g/mol
LogP2.92
Rot. Bonds4

About N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine

N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine (PubChem CID 54967779) has the molecular formula C14H15FN2 and a molecular weight of 230.29 g/mol. Its IUPAC name is N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine.

Molecular Properties

Compound NameN-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine
PubChem CID54967779
Molecular FormulaC14H15FN2
Molecular Weight230.29 g/mol
Exact Mass230.12
IUPAC NameN-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine
SMILESCCNC(c1ccccc1)c1cncc(F)c1
InChIInChI=1S/C14H15FN2/c1-2-17-14(11-6-4-3-5-7-11)12-8-13(15)10-16-9-12/h3-10,14,17H,2H2,1H3
InChIKeyQAZCHFDMFYFNCD-UHFFFAOYSA-N
XLogP2.92
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-chlorophenyl)-(5-fluoro-3-pyridinyl)methyl]ethanamine
CID 54967436
N-[(3,5-difluorophenyl)-phenylmethyl]ethanamine
CID 43489099
N-[bis(5-fluoro-3-pyridinyl)methyl]propan-1-amine
CID 105102198
N-[(1-ethylpyrazol-4-yl)-(5-fluoro-3-pyridinyl)methyl]ethanamine
CID 105108938
N-ethyl-1-(5-fluoro-3-pyridinyl)-2-phenylsulfanylethanamine
CID 65143289
N-[(5-fluoro-3-pyridinyl)-thieno[3,2-b]pyridin-6-ylmethyl]ethanamine
CID 81144068
N-[(2-chloro-3-methylphenyl)-(5-fluoro-3-pyridinyl)methyl]ethanamine
CID 115804806
N-benzhydrylethanamine;ethane
CID 142974710
N-[(2-bromo-3,4-difluorophenyl)-(5-fluoro-3-pyridinyl)methyl]ethanamine
CID 107539207
N-ethyl-3-(5-fluoro-3-pyridinyl)-1-phenylpropan-1-amine
CID 64500356
N-[(3,5-difluorophenyl)-pyrimidin-5-ylmethyl]ethanamine
CID 62491730
N-[(3,4-dichlorophenyl)-(3-fluorophenyl)methyl]ethanamine
CID 43492851

Frequently Asked Questions

What is the IUPAC name of N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine?
The IUPAC name of N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine (CID 54967779) is N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine.
What is the SMILES notation for N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine?
The canonical SMILES for N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine is CCNC(c1ccccc1)c1cncc(F)c1.
What is the InChIKey of N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine?
The InChIKey is QAZCHFDMFYFNCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2/c1-2-17-14(11-6-4-3-5-7-11)12-8-13(15)10-16-9-12/h3-10,14,17H,2H2,1H3.
What are the key properties of N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine?
N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine has a molecular weight of 230.29 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-fluoro-3-pyridinyl)-phenylmethyl]ethanamine is sourced from PubChem (CID 54967779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).