[3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol

C15H17FN2O — CID 112582984

IUPAC[3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol
SMILESCCC(Nc1cccc(CO)c1)c1ccc(F)cn1
InChIInChI=1S/C15H17FN2O/c1-2-14(15-7-6-12(16)9-17-15)18-13-5-3-4-11(8-13)10-19/h3-9,14,18-19H,2,10H2,1H3
InChIKeyMTUGQENNGMEALE-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.28
Rot. Bonds5

About [3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol

[3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol (PubChem CID 112582984) has the molecular formula C15H17FN2O and a molecular weight of 260.31 g/mol. Its IUPAC name is [3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol.

Molecular Properties

Compound Name[3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol
PubChem CID112582984
Molecular FormulaC15H17FN2O
Molecular Weight260.31 g/mol
Exact Mass260.13
IUPAC Name[3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol
SMILESCCC(Nc1cccc(CO)c1)c1ccc(F)cn1
InChIInChI=1S/C15H17FN2O/c1-2-14(15-7-6-12(16)9-17-15)18-13-5-3-4-11(8-13)10-19/h3-9,14,18-19H,2,10H2,1H3
InChIKeyMTUGQENNGMEALE-UHFFFAOYSA-N
XLogP3.28
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-N-[1-(5-fluoro-2-pyridinyl)propyl]aniline
CID 112582851
4-bromo-N-[1-(5-fluoro-2-pyridinyl)propyl]-3-methylaniline
CID 112582832
5-[1-(5-fluoro-2-pyridinyl)propylamino]-2-methoxyphenol
CID 115938609
1-N-[1-(5-fluoro-2-pyridinyl)propyl]-3-N,3-N,4-trimethylbenzene-1,3-diamine
CID 115938792
N-[1-(5-fluoro-2-pyridinyl)propyl]-4-methoxy-3-methylaniline
CID 115938694
[3-[1-(4-methylphenyl)propylamino]phenyl]methanol
CID 43715171
3-chloro-2-fluoro-N-[1-(5-fluoro-2-pyridinyl)propyl]aniline
CID 112582927
N-[1-(5-fluoro-2-pyridinyl)propyl]-4-methylsulfonylaniline
CID 115938417
2-[1-(5-fluoro-2-pyridinyl)propylamino]butan-1-ol
CID 112582914
2-bromo-4-fluoro-N-[1-(5-fluoro-2-pyridinyl)propyl]aniline
CID 112582924
1-[2-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]ethanol
CID 115938696
2-tert-butyl-N-[1-(5-fluoro-2-pyridinyl)propyl]aniline
CID 115938515

Frequently Asked Questions

What is the IUPAC name of [3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol?
The IUPAC name of [3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol (CID 112582984) is [3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol.
What is the SMILES notation for [3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol?
The canonical SMILES for [3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol is CCC(Nc1cccc(CO)c1)c1ccc(F)cn1.
What is the InChIKey of [3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol?
The InChIKey is MTUGQENNGMEALE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O/c1-2-14(15-7-6-12(16)9-17-15)18-13-5-3-4-11(8-13)10-19/h3-9,14,18-19H,2,10H2,1H3.
What are the key properties of [3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol?
[3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol has a molecular weight of 260.31 g/mol, XLogP of 3.28, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol is sourced from PubChem (CID 112582984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).