N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine

C13H13FN2O — CID 103802193

IUPACN-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine
SMILESCOc1ccc(NCc2cccc(F)c2)nc1
InChIInChI=1S/C13H13FN2O/c1-17-12-5-6-13(16-9-12)15-8-10-3-2-4-11(14)7-10/h2-7,9H,8H2,1H3,(H,15,16)
InChIKeySDCXHMLKHHOJQL-UHFFFAOYSA-N
MW232.26 g/mol
LogP2.84
Rot. Bonds4

About N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine

N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine (PubChem CID 103802193) has the molecular formula C13H13FN2O and a molecular weight of 232.26 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine
PubChem CID103802193
Molecular FormulaC13H13FN2O
Molecular Weight232.26 g/mol
Exact Mass232.10
IUPAC NameN-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine
SMILESCOc1ccc(NCc2cccc(F)c2)nc1
InChIInChI=1S/C13H13FN2O/c1-17-12-5-6-13(16-9-12)15-8-10-3-2-4-11(14)7-10/h2-7,9H,8H2,1H3,(H,15,16)
InChIKeySDCXHMLKHHOJQL-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

5-fluoro-N-[(3-methoxyphenyl)methyl]pyridin-2-amine
CID 61313135
5-fluoro-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
CID 61311584
2-(3-fluorophenyl)-N-[5-[(4-methoxyphenyl)methylamino]-2-pyridinyl]acetamide
CID 113027442
5-fluoro-N-[(3-methylphenyl)methyl]pyridin-2-amine
CID 61313338
N-[2-(3-fluorophenyl)ethyl]-5-methoxypyrimidin-2-amine
CID 114600378
N-[(4-bromophenyl)methyl]-5-methoxypyridin-2-amine
CID 103802163
5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine
CID 104861065
2-[(3-fluorophenyl)methylamino]-4-methoxybenzenecarbothioamide
CID 81306829
5-methoxy-N-(1H-pyrazol-4-ylmethyl)pyridin-2-amine
CID 103802199
4-N-[(3-fluorophenyl)methyl]-6-methoxypyrimidine-2,4-diamine
CID 114053013
5-methoxy-N-(thiophen-3-ylmethyl)pyridin-2-amine
CID 103802149
N-[(3-fluorophenyl)methyl]-2-methoxypyridin-3-amine
CID 43721741

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine?
The IUPAC name of N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine (CID 103802193) is N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine is COc1ccc(NCc2cccc(F)c2)nc1.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine?
The InChIKey is SDCXHMLKHHOJQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O/c1-17-12-5-6-13(16-9-12)15-8-10-3-2-4-11(14)7-10/h2-7,9H,8H2,1H3,(H,15,16).
What are the key properties of N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-amine?
N-[(3-fluorophenyl)methyl]-5-methoxypyridin-2-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]-5-methoxypyridin-2-amine is sourced from PubChem (CID 103802193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).