N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine

C16H26ClN3 — CID 83061614

IUPACN-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine
SMILESCCCC1CCCCN1c1ccc(Cl)c(CNCC)n1
InChIInChI=1S/C16H26ClN3/c1-3-7-13-8-5-6-11-20(13)16-10-9-14(17)15(19-16)12-18-4-2/h9-10,13,18H,3-8,11-12H2,1-2H3
InChIKeyOVHVWQYYWZCRIF-UHFFFAOYSA-N
MW295.86 g/mol
LogP4.00
Rot. Bonds6

About N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine

N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine (PubChem CID 83061614) has the molecular formula C16H26ClN3 and a molecular weight of 295.86 g/mol. Its IUPAC name is N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine
PubChem CID83061614
Molecular FormulaC16H26ClN3
Molecular Weight295.86 g/mol
Exact Mass295.18
IUPAC NameN-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine
SMILESCCCC1CCCCN1c1ccc(Cl)c(CNCC)n1
InChIInChI=1S/C16H26ClN3/c1-3-7-13-8-5-6-11-20(13)16-10-9-14(17)15(19-16)12-18-4-2/h9-10,13,18H,3-8,11-12H2,1-2H3
InChIKeyOVHVWQYYWZCRIF-UHFFFAOYSA-N
XLogP4.00
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.86
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine with MolForge

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Related Compounds

N-[[2-chloro-6-(2-propylpiperidin-1-yl)phenyl]methyl]ethanamine
CID 83055662
N-[[2-methyl-6-(2-propylpiperidin-1-yl)-3-pyridinyl]methyl]cyclopropanamine
CID 83044523
N-[[3-chloro-6-(3-methoxypyrrolidin-1-yl)-2-pyridinyl]methyl]ethanamine
CID 103539397
N-[[2-methyl-6-(2-propylpiperidin-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 83045595
N-[[3-chloro-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-2-pyridinyl]methyl]ethanamine
CID 79164517
2-bromo-6-(2-propylpiperidin-1-yl)pyridine
CID 83056141
3-chloro-6-(2-ethylpiperidin-1-yl)pyridine-2-carboxylic acid
CID 43266685
2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine
CID 83044693
4-methyl-6-(2-propylpiperidin-1-yl)pyrimidin-2-amine
CID 83056730
2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 83045593
N-[[3-chloro-6-(2,3-dimethylpiperidin-1-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62285541
N-[[3-chloro-6-(4-methylsulfonylpiperazin-1-yl)-2-pyridinyl]methyl]ethanamine
CID 63004009

Frequently Asked Questions

What is the IUPAC name of N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine (CID 83061614) is N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine is CCCC1CCCCN1c1ccc(Cl)c(CNCC)n1.
What is the InChIKey of N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine?
The InChIKey is OVHVWQYYWZCRIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26ClN3/c1-3-7-13-8-5-6-11-20(13)16-10-9-14(17)15(19-16)12-18-4-2/h9-10,13,18H,3-8,11-12H2,1-2H3.
What are the key properties of N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine?
N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine has a molecular weight of 295.86 g/mol, XLogP of 4.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 83061614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).