2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine

C15H17FN2O — CID 79251163

IUPAC2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine
SMILESCCCNc1ccnc(COc2cccc(F)c2)c1
InChIInChI=1S/C15H17FN2O/c1-2-7-17-13-6-8-18-14(10-13)11-19-15-5-3-4-12(16)9-15/h3-6,8-10H,2,7,11H2,1H3,(H,17,18)
InChIKeyJPCXFFNBZPAXLM-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.62
Rot. Bonds6

About 2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine

2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine (PubChem CID 79251163) has the molecular formula C15H17FN2O and a molecular weight of 260.31 g/mol. Its IUPAC name is 2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine.

Molecular Properties

Compound Name2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine
PubChem CID79251163
Molecular FormulaC15H17FN2O
Molecular Weight260.31 g/mol
Exact Mass260.13
IUPAC Name2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine
SMILESCCCNc1ccnc(COc2cccc(F)c2)c1
InChIInChI=1S/C15H17FN2O/c1-2-7-17-13-6-8-18-14(10-13)11-19-15-5-3-4-12(16)9-15/h3-6,8-10H,2,7,11H2,1H3,(H,17,18)
InChIKeyJPCXFFNBZPAXLM-UHFFFAOYSA-N
XLogP3.62
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(phenoxymethyl)-N-propylpyridin-4-amine
CID 79250988
2-[(3,4-difluorophenoxy)methyl]-N-propylpyridin-4-amine
CID 79251517
2-[(4-methylsulfanylphenoxy)methyl]-N-propylpyridin-4-amine
CID 79260330
2-[(3-methoxyphenyl)methoxymethyl]-N-propylpyridin-4-amine
CID 79245756
2-[(3-chlorophenoxy)methyl]-N-ethylpyridin-4-amine
CID 79251583
4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide
CID 79245655
N-propyl-2-[(2,4,6-trimethylphenoxy)methyl]pyridin-4-amine
CID 79261906
2-[(2-fluoro-5-methylphenoxy)methyl]-N-propylpyridin-4-amine
CID 79260153
2-[(2,5-dimethylphenoxy)methyl]-N-propylpyridin-4-amine
CID 79250898
3-ethoxy-N-propylaniline
CID 54800867
N-methyl-2-[[3-(trifluoromethyl)phenoxy]methyl]pyridin-4-amine
CID 79251088
N-[[2-[(3-fluorophenoxy)methyl]furan-3-yl]methyl]propan-1-amine
CID 62460294

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine?
The IUPAC name of 2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine (CID 79251163) is 2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine.
What is the SMILES notation for 2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine?
The canonical SMILES for 2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine is CCCNc1ccnc(COc2cccc(F)c2)c1.
What is the InChIKey of 2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine?
The InChIKey is JPCXFFNBZPAXLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O/c1-2-7-17-13-6-8-18-14(10-13)11-19-15-5-3-4-12(16)9-15/h3-6,8-10H,2,7,11H2,1H3,(H,17,18).
What are the key properties of 2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine?
2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine has a molecular weight of 260.31 g/mol, XLogP of 3.62, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine is sourced from PubChem (CID 79251163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).