1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine

C14H23N3O — CID 105073708

IUPAC1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine
SMILESCCOC1CCCN(c2cnccc2CNC)C1
InChIInChI=1S/C14H23N3O/c1-3-18-13-5-4-8-17(11-13)14-10-16-7-6-12(14)9-15-2/h6-7,10,13,15H,3-5,8-9,11H2,1-2H3
InChIKeyIHHZNVOGAUSBBX-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.81
Rot. Bonds5

About 1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine

1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine (PubChem CID 105073708) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine
PubChem CID105073708
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine
SMILESCCOC1CCCN(c2cnccc2CNC)C1
InChIInChI=1S/C14H23N3O/c1-3-18-13-5-4-8-17(11-13)14-10-16-7-6-12(14)9-15-2/h6-7,10,13,15H,3-5,8-9,11H2,1-2H3
InChIKeyIHHZNVOGAUSBBX-UHFFFAOYSA-N
XLogP1.81
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methyl]propan-1-amine
CID 105073711
[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]methanol
CID 105066787
N-[[4-(3-ethoxypiperidin-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 81247761
N-methyl-1-[3-(4-propan-2-ylazepan-1-yl)-4-pyridinyl]methanamine
CID 105074040
N-methyl-1-[3-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)-4-pyridinyl]methanamine
CID 105074260
N-methyl-1-[3-(4-methylpiperidin-1-yl)-4-pyridinyl]methanamine
CID 105072597
N-[[3-(3-ethylpiperidin-1-yl)-4-pyridinyl]methyl]cyclopropanamine
CID 105073026
N-[[3-chloro-4-(3-ethoxypiperidin-1-yl)phenyl]methyl]cyclopropanamine
CID 81143390
1-[3-(2,5-dihydropyrrol-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 130877424
1-[3-(2,6-dimethylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine
CID 105072641
1-[3-(2,3-dimethylpiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 105072555
N-[[3-[3-(methoxymethyl)piperidin-1-yl]-4-pyridinyl]methyl]propan-2-amine
CID 106589227

Frequently Asked Questions

What is the IUPAC name of 1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine (CID 105073708) is 1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine is CCOC1CCCN(c2cnccc2CNC)C1.
What is the InChIKey of 1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine?
The InChIKey is IHHZNVOGAUSBBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-3-18-13-5-4-8-17(11-13)14-10-16-7-6-12(14)9-15-2/h6-7,10,13,15H,3-5,8-9,11H2,1-2H3.
What are the key properties of 1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine?
1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine has a molecular weight of 249.36 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(3-ethoxypiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 105073708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).