N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine

C17H22N2O — CID 115939959

IUPACN-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine
SMILESCCNC(CC)c1ccc(Oc2ccccc2C)cn1
InChIInChI=1S/C17H22N2O/c1-4-15(18-5-2)16-11-10-14(12-19-16)20-17-9-7-6-8-13(17)3/h6-12,15,18H,4-5H2,1-3H3
InChIKeyDGLZKMKRRKOBMF-UHFFFAOYSA-N
MW270.38 g/mol
LogP4.24
Rot. Bonds6

About N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine

N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine (PubChem CID 115939959) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine
PubChem CID115939959
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine
SMILESCCNC(CC)c1ccc(Oc2ccccc2C)cn1
InChIInChI=1S/C17H22N2O/c1-4-15(18-5-2)16-11-10-14(12-19-16)20-17-9-7-6-8-13(17)3/h6-12,15,18H,4-5H2,1-3H3
InChIKeyDGLZKMKRRKOBMF-UHFFFAOYSA-N
XLogP4.24
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-[5-[(6-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine
CID 115940101
1-[5-(2-chloro-5-methylphenoxy)-2-pyridinyl]-N-ethylpropan-1-amine
CID 115940035
N-ethyl-1-[5-(4-methylsulfanylphenoxy)-2-pyridinyl]propan-1-amine
CID 115940125
N-ethyl-1-[5-(3-fluorophenoxy)-2-pyridinyl]propan-1-amine
CID 115939974
1-[5-(5-bromo-2-fluorophenoxy)-2-pyridinyl]-N-ethylpropan-1-amine
CID 114673855
1-(5-phenoxy-2-pyridinyl)-N-propylpropan-1-amine
CID 115939962
1-[5-(2-bromophenoxy)-2-pyridinyl]-N-ethylethanamine
CID 83126946
N-ethyl-1-[5-(5-fluoro-2-methylphenoxy)-2-pyridinyl]ethanamine
CID 102982283
N-ethyl-1-[5-(thiophen-2-ylmethoxy)-2-pyridinyl]propan-1-amine
CID 112584875
N-propyl-1-(5-pyridin-3-yloxy-2-pyridinyl)propan-1-amine
CID 115940028
1-(5-methoxy-2-pyridinyl)-N-propylpropan-1-amine
CID 112584694
(1S)-1-[5-(2-iodophenoxy)-2-pyridinyl]propan-1-ol
CID 103939168

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine?
The IUPAC name of N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine (CID 115939959) is N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine.
What is the SMILES notation for N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine?
The canonical SMILES for N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine is CCNC(CC)c1ccc(Oc2ccccc2C)cn1.
What is the InChIKey of N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine?
The InChIKey is DGLZKMKRRKOBMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-4-15(18-5-2)16-11-10-14(12-19-16)20-17-9-7-6-8-13(17)3/h6-12,15,18H,4-5H2,1-3H3.
What are the key properties of N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine?
N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine has a molecular weight of 270.38 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[5-(2-methylphenoxy)-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 115939959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).