N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine

C9H13FN2O — CID 23572216

IUPACN-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine
SMILESCOc1ccc(C)c(NCCF)n1
InChIInChI=1S/C9H13FN2O/c1-7-3-4-8(13-2)12-9(7)11-6-5-10/h3-4H,5-6H2,1-2H3,(H,11,12)
InChIKeyLHGPZPQGHXNWPZ-UHFFFAOYSA-N
MW184.21 g/mol
LogP1.78
Rot. Bonds4

About N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine

N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine (PubChem CID 23572216) has the molecular formula C9H13FN2O and a molecular weight of 184.21 g/mol. Its IUPAC name is N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine
PubChem CID23572216
Molecular FormulaC9H13FN2O
Molecular Weight184.21 g/mol
Exact Mass184.10
IUPAC NameN-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine
SMILESCOc1ccc(C)c(NCCF)n1
InChIInChI=1S/C9H13FN2O/c1-7-3-4-8(13-2)12-9(7)11-6-5-10/h3-4H,5-6H2,1-2H3,(H,11,12)
InChIKeyLHGPZPQGHXNWPZ-UHFFFAOYSA-N
XLogP1.78
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.21
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine?
The IUPAC name of N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine (CID 23572216) is N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine.
What is the SMILES notation for N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine?
The canonical SMILES for N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine is COc1ccc(C)c(NCCF)n1.
What is the InChIKey of N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine?
The InChIKey is LHGPZPQGHXNWPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13FN2O/c1-7-3-4-8(13-2)12-9(7)11-6-5-10/h3-4H,5-6H2,1-2H3,(H,11,12).
What are the key properties of N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine?
N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine has a molecular weight of 184.21 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-6-methoxy-3-methylpyridin-2-amine is sourced from PubChem (CID 23572216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).