N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine

C18H24N2O — CID 116773849

IUPACN-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine
SMILESCCCNC(c1cccnc1)C(OCC)c1ccccc1
InChIInChI=1S/C18H24N2O/c1-3-12-20-17(16-11-8-13-19-14-16)18(21-4-2)15-9-6-5-7-10-15/h5-11,13-14,17-18,20H,3-4,12H2,1-2H3
InChIKeyQYGALJZLWJFJNW-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.90
Rot. Bonds8

About N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine

N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine (PubChem CID 116773849) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine.

Molecular Properties

Compound NameN-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine
PubChem CID116773849
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine
SMILESCCCNC(c1cccnc1)C(OCC)c1ccccc1
InChIInChI=1S/C18H24N2O/c1-3-12-20-17(16-11-8-13-19-14-16)18(21-4-2)15-9-6-5-7-10-15/h5-11,13-14,17-18,20H,3-4,12H2,1-2H3
InChIKeyQYGALJZLWJFJNW-UHFFFAOYSA-N
XLogP3.90
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-propyl-1-pyridin-3-ylbutan-1-amine
CID 63716862
2-methyl-N-propyl-1-pyridin-3-ylpentan-1-amine
CID 115799813
2-ethoxy-N-ethyl-1-(6-methyl-3-pyridinyl)-2-phenylethanamine
CID 116773800
2-methyl-2-phenyl-N-propyl-1-pyridin-3-ylpropan-1-amine
CID 63084520
1-ethoxy-1-phenyl-N-propyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 116773875
3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine
CID 116773275
N-[(4-ethoxyphenyl)-pyridin-3-ylmethyl]propan-1-amine
CID 43495177
N-[(3-methylcyclopentyl)-pyridin-3-ylmethyl]propan-1-amine
CID 65413186
N-[(1-phenylcyclobutyl)-pyridin-3-ylmethyl]propan-1-amine
CID 63078815
ethyl 3-(propylamino)-3-pyridin-3-ylpropanoate
CID 65235826
(2-ethoxy-1,2-diphenylethyl)hydrazine
CID 105279207
2-phenyl-N-propyl-1-pyrazin-2-ylbutan-1-amine
CID 115860421

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine?
The IUPAC name of N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine (CID 116773849) is N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine.
What is the SMILES notation for N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine?
The canonical SMILES for N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine is CCCNC(c1cccnc1)C(OCC)c1ccccc1.
What is the InChIKey of N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine?
The InChIKey is QYGALJZLWJFJNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-3-12-20-17(16-11-8-13-19-14-16)18(21-4-2)15-9-6-5-7-10-15/h5-11,13-14,17-18,20H,3-4,12H2,1-2H3.
What are the key properties of N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine?
N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine has a molecular weight of 284.40 g/mol, XLogP of 3.90, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine is sourced from PubChem (CID 116773849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).