1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine

C14H17FN2O — CID 83117358

IUPAC1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine
SMILESCc1ccc(C(C)NC(C)c2ccc(F)cn2)o1
InChIInChI=1S/C14H17FN2O/c1-9-4-7-14(18-9)11(3)17-10(2)13-6-5-12(15)8-16-13/h4-8,10-11,17H,1-3H3
InChIKeyGIASGDUJQHOZKC-UHFFFAOYSA-N
MW248.30 g/mol
LogP3.53
Rot. Bonds4

About 1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine

1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine (PubChem CID 83117358) has the molecular formula C14H17FN2O and a molecular weight of 248.30 g/mol. Its IUPAC name is 1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine.

Molecular Properties

Compound Name1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine
PubChem CID83117358
Molecular FormulaC14H17FN2O
Molecular Weight248.30 g/mol
Exact Mass248.13
IUPAC Name1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine
SMILESCc1ccc(C(C)NC(C)c2ccc(F)cn2)o1
InChIInChI=1S/C14H17FN2O/c1-9-4-7-14(18-9)11(3)17-10(2)13-6-5-12(15)8-16-13/h4-8,10-11,17H,1-3H3
InChIKeyGIASGDUJQHOZKC-UHFFFAOYSA-N
XLogP3.53
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.30
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-fluoro-2-pyridinyl)-N-[(5-methylfuran-2-yl)methyl]ethanamine
CID 83119707
N-[1-(2,5-difluorophenyl)ethyl]-1-(5-methylfuran-2-yl)ethanamine
CID 43674237
(2S)-2-[1-(5-fluoro-2-pyridinyl)ethylamino]propan-1-ol
CID 103895006
N-[1-(5-fluoro-2-pyridinyl)ethyl]-1-methylsulfanylpropan-2-amine
CID 115886385
1-cyclopropyl-N-[1-(5-fluoro-2-pyridinyl)ethyl]ethanamine
CID 83117431
N-[1-(2-bromophenyl)ethyl]-1-(5-fluoro-2-pyridinyl)ethanamine
CID 83117357
5-fluoro-2-[1-[1-(5-methylfuran-2-yl)ethylamino]ethyl]phenol
CID 63064633
1-(5-fluoro-2-pyridinyl)-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]ethanamine
CID 106281911
2,2-difluoro-N-[1-(5-fluoro-2-pyridinyl)ethyl]ethanamine
CID 83119275
4,4,4-trifluoro-N-[1-(5-fluoro-2-pyridinyl)ethyl]butan-2-amine
CID 104860347
2-N-[1-(5-fluoro-2-pyridinyl)ethyl]-1-N,1-N-dimethylpropane-1,2-diamine
CID 83119730
N-[1-(5-fluoro-2-pyridinyl)ethyl]but-2-yn-1-amine
CID 115896973

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine?
The IUPAC name of 1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine (CID 83117358) is 1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine.
What is the SMILES notation for 1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine?
The canonical SMILES for 1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine is Cc1ccc(C(C)NC(C)c2ccc(F)cn2)o1.
What is the InChIKey of 1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine?
The InChIKey is GIASGDUJQHOZKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O/c1-9-4-7-14(18-9)11(3)17-10(2)13-6-5-12(15)8-16-13/h4-8,10-11,17H,1-3H3.
What are the key properties of 1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine?
1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine has a molecular weight of 248.30 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-pyridinyl)-N-[1-(5-methylfuran-2-yl)ethyl]ethanamine is sourced from PubChem (CID 83117358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).