N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine

C14H15FN2O — CID 62194578

IUPACN-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine
SMILESCCNc1ccc(COc2ccccc2F)cn1
InChIInChI=1S/C14H15FN2O/c1-2-16-14-8-7-11(9-17-14)10-18-13-6-4-3-5-12(13)15/h3-9H,2,10H2,1H3,(H,16,17)
InChIKeyHVVDGJVXOHLPAW-UHFFFAOYSA-N
MW246.28 g/mol
LogP3.23
Rot. Bonds5

About N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine

N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine (PubChem CID 62194578) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine
PubChem CID62194578
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC NameN-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine
SMILESCCNc1ccc(COc2ccccc2F)cn1
InChIInChI=1S/C14H15FN2O/c1-2-16-14-8-7-11(9-17-14)10-18-13-6-4-3-5-12(13)15/h3-9H,2,10H2,1H3,(H,16,17)
InChIKeyHVVDGJVXOHLPAW-UHFFFAOYSA-N
XLogP3.23
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine?
The IUPAC name of N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine (CID 62194578) is N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine.
What is the SMILES notation for N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine?
The canonical SMILES for N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine is CCNc1ccc(COc2ccccc2F)cn1.
What is the InChIKey of N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine?
The InChIKey is HVVDGJVXOHLPAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-2-16-14-8-7-11(9-17-14)10-18-13-6-4-3-5-12(13)15/h3-9H,2,10H2,1H3,(H,16,17).
What are the key properties of N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine?
N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine has a molecular weight of 246.28 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine is sourced from PubChem (CID 62194578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).