1-(3-pyridin-3-yloxyphenyl)propan-2-amine

C14H16N2O — CID 63941950

IUPAC1-(3-pyridin-3-yloxyphenyl)propan-2-amine
SMILESCC(N)Cc1cccc(Oc2cccnc2)c1
InChIInChI=1S/C14H16N2O/c1-11(15)8-12-4-2-5-13(9-12)17-14-6-3-7-16-10-14/h2-7,9-11H,8,15H2,1H3
InChIKeyWMXODGHPEZIEOQ-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.76
Rot. Bonds4

About 1-(3-pyridin-3-yloxyphenyl)propan-2-amine

1-(3-pyridin-3-yloxyphenyl)propan-2-amine (PubChem CID 63941950) has the molecular formula C14H16N2O and a molecular weight of 228.29 g/mol. Its IUPAC name is 1-(3-pyridin-3-yloxyphenyl)propan-2-amine.

Molecular Properties

Compound Name1-(3-pyridin-3-yloxyphenyl)propan-2-amine
PubChem CID63941950
Molecular FormulaC14H16N2O
Molecular Weight228.29 g/mol
Exact Mass228.13
IUPAC Name1-(3-pyridin-3-yloxyphenyl)propan-2-amine
SMILESCC(N)Cc1cccc(Oc2cccnc2)c1
InChIInChI=1S/C14H16N2O/c1-11(15)8-12-4-2-5-13(9-12)17-14-6-3-7-16-10-14/h2-7,9-11H,8,15H2,1H3
InChIKeyWMXODGHPEZIEOQ-UHFFFAOYSA-N
XLogP2.76
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(3-ethylphenoxy)phenyl]propan-2-amine
CID 63942734
4-[3-(2-aminopropyl)phenoxy]aniline
CID 116996628
1-(3-pyridin-3-ylphenyl)propan-2-amine
CID 131562841
1-[3-(3,5-dimethoxyphenoxy)phenyl]propan-2-amine
CID 63941754
1-[3-(3,5-difluorophenoxy)phenyl]propan-2-amine
CID 63943526
1-[3-(4-ethoxyphenoxy)phenyl]propan-2-amine
CID 63941952
1-[3-(pyrimidin-2-ylmethoxy)phenyl]propan-2-amine
CID 62699214
1-[3-(2-methoxyphenoxy)phenyl]propan-2-amine
CID 63943521
1-[3-(3-bromo-4-fluorophenoxy)phenyl]propan-2-amine
CID 83234688
2-(3-methoxyphenyl)-1-pyridin-3-ylethanamine
CID 22299530
1-[3-(2,3-dihydro-1H-inden-5-yloxy)phenyl]propan-2-amine
CID 63942350
1-[3-(2-methylpropoxy)phenyl]propan-2-amine
CID 60907864

Frequently Asked Questions

What is the IUPAC name of 1-(3-pyridin-3-yloxyphenyl)propan-2-amine?
The IUPAC name of 1-(3-pyridin-3-yloxyphenyl)propan-2-amine (CID 63941950) is 1-(3-pyridin-3-yloxyphenyl)propan-2-amine.
What is the SMILES notation for 1-(3-pyridin-3-yloxyphenyl)propan-2-amine?
The canonical SMILES for 1-(3-pyridin-3-yloxyphenyl)propan-2-amine is CC(N)Cc1cccc(Oc2cccnc2)c1.
What is the InChIKey of 1-(3-pyridin-3-yloxyphenyl)propan-2-amine?
The InChIKey is WMXODGHPEZIEOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-11(15)8-12-4-2-5-13(9-12)17-14-6-3-7-16-10-14/h2-7,9-11H,8,15H2,1H3.
What are the key properties of 1-(3-pyridin-3-yloxyphenyl)propan-2-amine?
1-(3-pyridin-3-yloxyphenyl)propan-2-amine has a molecular weight of 228.29 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-pyridin-3-yloxyphenyl)propan-2-amine is sourced from PubChem (CID 63941950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).