N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine

C13H13FN2O — CID 43721741

IUPACN-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine
SMILESCOc1ncccc1NCc1cccc(F)c1
InChIInChI=1S/C13H13FN2O/c1-17-13-12(6-3-7-15-13)16-9-10-4-2-5-11(14)8-10/h2-8,16H,9H2,1H3
InChIKeyYMAWGNYWLAUATH-UHFFFAOYSA-N
MW232.26 g/mol
LogP2.84
Rot. Bonds4

About N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine

N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine (PubChem CID 43721741) has the molecular formula C13H13FN2O and a molecular weight of 232.26 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine
PubChem CID43721741
Molecular FormulaC13H13FN2O
Molecular Weight232.26 g/mol
Exact Mass232.10
IUPAC NameN-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine
SMILESCOc1ncccc1NCc1cccc(F)c1
InChIInChI=1S/C13H13FN2O/c1-17-13-12(6-3-7-15-13)16-9-10-4-2-5-11(14)8-10/h2-8,16H,9H2,1H3
InChIKeyYMAWGNYWLAUATH-UHFFFAOYSA-N
XLogP2.84
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-[(3-propoxyphenyl)methyl]pyridin-3-amine
CID 61016634
2-fluoro-N-[(2-methoxy-3-pyridinyl)methyl]-3-methylaniline
CID 114254628
4-[[(2-methoxy-3-pyridinyl)amino]methyl]-2,6-dimethylphenol
CID 43721997
2-methoxy-N-[[4-(trifluoromethylsulfanyl)phenyl]methyl]pyridin-3-amine
CID 43721790
N-(isoquinolin-6-ylmethyl)-2-methoxypyridin-3-amine
CID 107037935
2-ethoxy-N-[(3-methylphenyl)methyl]pyridin-3-amine
CID 43706224
2-ethoxy-N-[(3-ethoxyphenyl)methyl]pyridin-3-amine
CID 60874271
3-[(3-fluorophenyl)methyl]-1-[(2-methoxy-3-pyridinyl)methyl]-1-methylurea
CID 53185039
N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine
CID 103802193
N-[(3-bromophenyl)methyl]-2-propan-2-yloxypyridin-3-amine
CID 63454228
3-fluoro-N-(2-methoxy-3-pyridinyl)benzamide
CID 47038518
3-chloro-2-fluoro-N-[(3-fluorophenyl)methyl]aniline
CID 28879731

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine?
The IUPAC name of N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine (CID 43721741) is N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine is COc1ncccc1NCc1cccc(F)c1.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine?
The InChIKey is YMAWGNYWLAUATH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O/c1-17-13-12(6-3-7-15-13)16-9-10-4-2-5-11(14)8-10/h2-8,16H,9H2,1H3.
What are the key properties of N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine?
N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine has a molecular weight of 232.26 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine is sourced from PubChem (CID 43721741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).