1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine

C16H19FN2O — CID 102883519

IUPAC1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine
SMILESCNC(c1ccc(OC)cc1F)C(C)c1ccccn1
InChIInChI=1S/C16H19FN2O/c1-11(15-6-4-5-9-19-15)16(18-2)13-8-7-12(20-3)10-14(13)17/h4-11,16,18H,1-3H3
InChIKeyUKBMMNJBISMFEC-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.29
Rot. Bonds5

About 1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine

1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine (PubChem CID 102883519) has the molecular formula C16H19FN2O and a molecular weight of 274.34 g/mol. Its IUPAC name is 1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine
PubChem CID102883519
Molecular FormulaC16H19FN2O
Molecular Weight274.34 g/mol
Exact Mass274.15
IUPAC Name1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine
SMILESCNC(c1ccc(OC)cc1F)C(C)c1ccccn1
InChIInChI=1S/C16H19FN2O/c1-11(15-6-4-5-9-19-15)16(18-2)13-8-7-12(20-3)10-14(13)17/h4-11,16,18H,1-3H3
InChIKeyUKBMMNJBISMFEC-UHFFFAOYSA-N
XLogP3.29
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chloro-2-fluorophenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine
CID 66448579
2-cyclopropyl-1-(2-fluoro-4-methoxyphenyl)-N-methylpropan-1-amine
CID 83154390
N-methyl-1-phenyl-2-pyridin-2-ylpropan-1-amine
CID 66447604
3-[(2-fluoro-4-methoxyphenyl)-(methylamino)methyl]pyridin-2-amine
CID 81304169
N-ethyl-1-(2-fluoro-4-methoxyphenyl)-2-pyridin-2-ylethanamine
CID 81304832
2-[1-bromo-1-(2-bromo-5-methoxyphenyl)propan-2-yl]pyridine
CID 66452706
1-(3-chloro-2-pyridinyl)-1-(2-fluoro-4-methoxyphenyl)-N-methylmethanamine
CID 103444034
(2-fluoro-4-methoxyphenyl)-pyrimidin-2-ylmethanamine
CID 103395513
N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine
CID 66447023
5-methoxy-2-[1-[[(1R)-1-pyridin-2-ylethyl]amino]ethyl]phenol
CID 81402064
1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-(3-methyl-2-pyridinyl)ethanamine
CID 102883527
(2,4-dimethoxyphenyl)-pyridin-2-ylmethanol
CID 62801796

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine?
The IUPAC name of 1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine (CID 102883519) is 1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine is CNC(c1ccc(OC)cc1F)C(C)c1ccccn1.
What is the InChIKey of 1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine?
The InChIKey is UKBMMNJBISMFEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2O/c1-11(15-6-4-5-9-19-15)16(18-2)13-8-7-12(20-3)10-14(13)17/h4-11,16,18H,1-3H3.
What are the key properties of 1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine?
1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine has a molecular weight of 274.34 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-4-methoxyphenyl)-N-methyl-2-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 102883519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).