1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine

C14H16FN3O — CID 114833857

IUPAC1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine
SMILESCOc1nccnc1C(C)(N)Cc1ccc(F)cc1
InChIInChI=1S/C14H16FN3O/c1-14(16,9-10-3-5-11(15)6-4-10)12-13(19-2)18-8-7-17-12/h3-8H,9,16H2,1-2H3
InChIKeyCOENWLPUTMIHKJ-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.04
Rot. Bonds4

About 1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine

1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine (PubChem CID 114833857) has the molecular formula C14H16FN3O and a molecular weight of 261.30 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine
PubChem CID114833857
Molecular FormulaC14H16FN3O
Molecular Weight261.30 g/mol
Exact Mass261.13
IUPAC Name1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine
SMILESCOc1nccnc1C(C)(N)Cc1ccc(F)cc1
InChIInChI=1S/C14H16FN3O/c1-14(16,9-10-3-5-11(15)6-4-10)12-13(19-2)18-8-7-17-12/h3-8H,9,16H2,1-2H3
InChIKeyCOENWLPUTMIHKJ-UHFFFAOYSA-N
XLogP2.04
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-fluorophenyl)-2-pyrimidin-2-ylpropan-2-amine
CID 165485022
1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine
CID 114833720
1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine
CID 104514796
1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine
CID 114833903
2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine
CID 104516755
1-(5-fluoro-2-pyridinyl)-1-(3-methoxypyrazin-2-yl)ethanol
CID 104514737
1-(4-fluorophenyl)-2-methylpropan-2-amine;hydrochloride
CID 22597146
2-(4-fluorophenyl)-1-(4-methylphenyl)propan-2-amine
CID 60799223
2-(5-fluoro-2-methylphenyl)-1-(4-fluorophenyl)propan-2-amine
CID 114833839
2-(3-fluorophenyl)-1-(4-fluorophenyl)propan-2-amine
CID 60798625
1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine
CID 114833902
4-fluoro-5-methoxy-4-(3-methoxypyrazin-2-yl)pentan-1-amine
CID 103392369

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine?
The IUPAC name of 1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine (CID 114833857) is 1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine.
What is the SMILES notation for 1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine?
The canonical SMILES for 1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine is COc1nccnc1C(C)(N)Cc1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine?
The InChIKey is COENWLPUTMIHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O/c1-14(16,9-10-3-5-11(15)6-4-10)12-13(19-2)18-8-7-17-12/h3-8H,9,16H2,1-2H3.
What are the key properties of 1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine?
1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine has a molecular weight of 261.30 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine is sourced from PubChem (CID 114833857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).