N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine

C16H27N3 — CID 62284695

IUPACN-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine
SMILESCCCC1CCN(c2ncccc2CNCC)CC1
InChIInChI=1S/C16H27N3/c1-3-6-14-8-11-19(12-9-14)16-15(13-17-4-2)7-5-10-18-16/h5,7,10,14,17H,3-4,6,8-9,11-13H2,1-2H3
InChIKeyZXNGSOLDIVSADG-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.21
Rot. Bonds6

About N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine

N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine (PubChem CID 62284695) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine
PubChem CID62284695
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC NameN-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine
SMILESCCCC1CCN(c2ncccc2CNCC)CC1
InChIInChI=1S/C16H27N3/c1-3-6-14-8-11-19(12-9-14)16-15(13-17-4-2)7-5-10-18-16/h5,7,10,14,17H,3-4,6,8-9,11-13H2,1-2H3
InChIKeyZXNGSOLDIVSADG-UHFFFAOYSA-N
XLogP3.21
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-3-pyridinyl]methyl]ethanamine
CID 79170955
N-[[2-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)-3-pyridinyl]methyl]ethanamine
CID 81199266
[2-(4-ethylpiperidin-1-yl)-3-pyridinyl]methanol
CID 61421598
N-[[2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)-3-pyridinyl]methyl]ethanamine
CID 63152821
N-[[2-(4-ethoxypiperidin-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 62282809
N-[[1-(3-fluoro-2-pyridinyl)piperidin-4-yl]methyl]ethanamine
CID 55111529
N-[[4-(4-propylazepan-1-yl)-3-pyridinyl]methyl]ethanamine
CID 81247994
N-[[2-[4-(methoxymethyl)piperidin-1-yl]-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 63972016
N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 62286453
N-methyl-1-[2-(4-methylpiperidin-1-yl)-3-pyridinyl]methanamine
CID 62286090
3-(chloromethyl)-2-(4-ethylpiperidin-1-yl)pyridine
CID 61421741
N-[[2-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-3-pyridinyl]methyl]ethanamine
CID 62293718

Frequently Asked Questions

What is the IUPAC name of N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine (CID 62284695) is N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine is CCCC1CCN(c2ncccc2CNCC)CC1.
What is the InChIKey of N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine?
The InChIKey is ZXNGSOLDIVSADG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-3-6-14-8-11-19(12-9-14)16-15(13-17-4-2)7-5-10-18-16/h5,7,10,14,17H,3-4,6,8-9,11-13H2,1-2H3.
What are the key properties of N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine?
N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine has a molecular weight of 261.41 g/mol, XLogP of 3.21, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-propylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 62284695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).