1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine

C16H20N2 — CID 105121774

IUPAC1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine
SMILESCCc1ccc(C(N)CCc2ccccn2)cc1
InChIInChI=1S/C16H20N2/c1-2-13-6-8-14(9-7-13)16(17)11-10-15-5-3-4-12-18-15/h3-9,12,16H,2,10-11,17H2,1H3
InChIKeyRHDRYDJJUMTXEX-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.28
Rot. Bonds5

About 1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine

1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine (PubChem CID 105121774) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine
PubChem CID105121774
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine
SMILESCCc1ccc(C(N)CCc2ccccn2)cc1
InChIInChI=1S/C16H20N2/c1-2-13-6-8-14(9-7-13)16(17)11-10-15-5-3-4-12-18-15/h3-9,12,16H,2,10-11,17H2,1H3
InChIKeyRHDRYDJJUMTXEX-UHFFFAOYSA-N
XLogP3.28
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-ethylpyrazol-4-yl)-3-pyridin-2-ylpropan-1-amine
CID 105109214
1-(4-ethylphenyl)-4-pyridin-2-ylbutan-2-ol
CID 105080302
(1R)-1-[4-(2-pyridin-2-ylethoxy)phenyl]propan-1-amine
CID 78937530
(2S)-4-pyridin-2-ylbutan-2-amine
CID 22831528
1-(2-chlorophenyl)-3-pyridin-2-ylpropan-1-amine
CID 105099874
1-(3-chlorophenyl)-3-pyridin-2-ylpropan-1-amine
CID 105106557
2-[3-[(4-ethylphenyl)methoxy]propyl]pyridine
CID 134328628
1-ethoxy-4-pyridin-2-ylbutan-2-amine
CID 105165178
1-(5-ethyl-2-pyridinyl)-N-methyl-4-pyridin-2-ylbutan-2-amine
CID 105168957
2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine
CID 134852972
1-(2-propan-2-ylpyrazol-3-yl)-3-pyridin-2-ylpropan-1-amine
CID 114198061
2-(3-ethyl-4-methylpentyl)pyridine
CID 67454741

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine?
The IUPAC name of 1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine (CID 105121774) is 1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine is CCc1ccc(C(N)CCc2ccccn2)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine?
The InChIKey is RHDRYDJJUMTXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-2-13-6-8-14(9-7-13)16(17)11-10-15-5-3-4-12-18-15/h3-9,12,16H,2,10-11,17H2,1H3.
What are the key properties of 1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine?
1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine has a molecular weight of 240.35 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 105121774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).