5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine

C17H23N3 — CID 80633649

IUPAC5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine
SMILESCCC(N)Cc1ccc(N(CC)c2ccccc2)nc1
InChIInChI=1S/C17H23N3/c1-3-15(18)12-14-10-11-17(19-13-14)20(4-2)16-8-6-5-7-9-16/h5-11,13,15H,3-4,12,18H2,1-2H3
InChIKeyCBLSYHVWUIJDGN-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.52
Rot. Bonds6

About 5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine

5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine (PubChem CID 80633649) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine.

Molecular Properties

Compound Name5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine
PubChem CID80633649
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine
SMILESCCC(N)Cc1ccc(N(CC)c2ccccc2)nc1
InChIInChI=1S/C17H23N3/c1-3-15(18)12-14-10-11-17(19-13-14)20(4-2)16-8-6-5-7-9-16/h5-11,13,15H,3-4,12,18H2,1-2H3
InChIKeyCBLSYHVWUIJDGN-UHFFFAOYSA-N
XLogP3.52
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-aminobutyl)-N-ethyl-N-(4-methylphenyl)pyridin-2-amine
CID 80630089
5-(2-aminobutyl)-N-ethyl-N-(3-fluorophenyl)pyridin-2-amine
CID 80637193
5-(2-aminobutyl)-N-methyl-N-propylpyridin-2-amine
CID 80634035
5-(2-aminobutyl)-N-methyl-N-propan-2-ylpyridin-2-amine
CID 80632913
5-(2-aminobutyl)-N-(2-ethoxyethyl)-N-ethylpyridin-2-amine
CID 80635154
5-(2-aminobutyl)-N-ethyl-N-(1-methoxypropan-2-yl)pyridin-2-amine
CID 80635244
5-(2-aminobutyl)-N-methyl-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 80634634
5-(2-aminobutyl)-N-methyl-N-(thiophen-3-ylmethyl)pyridin-2-amine
CID 80633966
5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine
CID 80633726
2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide
CID 113017550
1-(4-phenylphenyl)butan-2-amine
CID 23591877
1-(6-pyridin-2-ylsulfanyl-3-pyridinyl)butan-2-amine
CID 80650790

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine?
The IUPAC name of 5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine (CID 80633649) is 5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine.
What is the SMILES notation for 5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine?
The canonical SMILES for 5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine is CCC(N)Cc1ccc(N(CC)c2ccccc2)nc1.
What is the InChIKey of 5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine?
The InChIKey is CBLSYHVWUIJDGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-3-15(18)12-14-10-11-17(19-13-14)20(4-2)16-8-6-5-7-9-16/h5-11,13,15H,3-4,12,18H2,1-2H3.
What are the key properties of 5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine?
5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine has a molecular weight of 269.39 g/mol, XLogP of 3.52, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminobutyl)-N-ethyl-N-phenylpyridin-2-amine is sourced from PubChem (CID 80633649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).