N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine

C18H24N2 — CID 105171233

IUPACN-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine
SMILESCCNC(CCc1cccnc1)c1cccc(CC)c1
InChIInChI=1S/C18H24N2/c1-3-15-7-5-9-17(13-15)18(20-4-2)11-10-16-8-6-12-19-14-16/h5-9,12-14,18,20H,3-4,10-11H2,1-2H3
InChIKeyYPCXKQIHQCHVHH-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.93
Rot. Bonds7

About N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine

N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine (PubChem CID 105171233) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine
PubChem CID105171233
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC NameN-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine
SMILESCCNC(CCc1cccnc1)c1cccc(CC)c1
InChIInChI=1S/C18H24N2/c1-3-15-7-5-9-17(13-15)18(20-4-2)11-10-16-8-6-12-19-14-16/h5-9,12-14,18,20H,3-4,10-11H2,1-2H3
InChIKeyYPCXKQIHQCHVHH-UHFFFAOYSA-N
XLogP3.93
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,5-difluorophenyl)-N-ethyl-3-pyridin-3-ylpropan-1-amine
CID 105142109
N-ethyl-1-(4-propylphenyl)-3-pyridin-3-ylpropan-1-amine
CID 105144433
1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-ol
CID 105117283
N-ethyl-1-(3-ethylphenyl)-3-(2-methylphenyl)propan-1-amine
CID 105171234
N-ethyl-1-(4-methyl-3-pyridinyl)-3-pyridin-3-ylpropan-1-amine
CID 105164345
1-(4-chloro-3-methoxyphenyl)-N-ethyl-3-pyridin-3-ylpropan-1-amine
CID 105164610
N-ethyl-3-(4-methylphenyl)-1-pyridin-3-ylpropan-1-amine
CID 105098484
N-ethyl-3-pyridin-3-yl-1-thiophen-2-ylpropan-1-amine
CID 105100649
N-ethyl-1-[3-(2-methylpropyl)phenyl]-2-pyridin-3-ylethanamine
CID 116544214
N-ethyl-1-phenyl-5-pyridin-3-ylpentan-3-amine
CID 105094322
N-ethyl-1-(3-ethylphenyl)-3-methylsulfanylpropan-1-amine
CID 105171168
1-(3-bromo-2-fluorophenyl)-N-ethyl-3-pyridin-3-ylpropan-1-amine
CID 106647869

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine?
The IUPAC name of N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine (CID 105171233) is N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine.
What is the SMILES notation for N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine?
The canonical SMILES for N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine is CCNC(CCc1cccnc1)c1cccc(CC)c1.
What is the InChIKey of N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine?
The InChIKey is YPCXKQIHQCHVHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-3-15-7-5-9-17(13-15)18(20-4-2)11-10-16-8-6-12-19-14-16/h5-9,12-14,18,20H,3-4,10-11H2,1-2H3.
What are the key properties of N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine?
N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine has a molecular weight of 268.40 g/mol, XLogP of 3.93, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine is sourced from PubChem (CID 105171233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).