N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine

C14H23N3 — CID 63854795

IUPACN-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine
SMILESCNC(C)C1CCCN(Cc2ccncc2)C1
InChIInChI=1S/C14H23N3/c1-12(15-2)14-4-3-9-17(11-14)10-13-5-7-16-8-6-13/h5-8,12,14-15H,3-4,9-11H2,1-2H3
InChIKeyAOPYDHKNAFPFGE-UHFFFAOYSA-N
MW233.36 g/mol
LogP1.90
Rot. Bonds4

About N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine

N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine (PubChem CID 63854795) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine
PubChem CID63854795
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine
SMILESCNC(C)C1CCCN(Cc2ccncc2)C1
InChIInChI=1S/C14H23N3/c1-12(15-2)14-4-3-9-17(11-14)10-13-5-7-16-8-6-13/h5-8,12,14-15H,3-4,9-11H2,1-2H3
InChIKeyAOPYDHKNAFPFGE-UHFFFAOYSA-N
XLogP1.90
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[1-(pyridin-3-ylmethyl)piperidin-3-yl]ethanamine
CID 55256845
1-[1-[(3-methoxyphenyl)methyl]piperidin-3-yl]-N-methylethanamine
CID 63852701
4-[(3-fluoropiperidin-1-yl)methyl]pyridine
CID 171701781
4-[(3-methylpiperidin-1-yl)methyl]pyridine
CID 121401070
N-methyl-1-[1-(quinolin-8-ylmethyl)piperidin-3-yl]ethanamine
CID 63854973
1-[1-[(3-fluoro-4-methoxyphenyl)methyl]piperidin-3-yl]-N-methylethanamine
CID 63855146
N-ethyl-1-[1-[(4-ethylphenyl)methyl]piperidin-3-yl]ethanamine
CID 63853942
1-[1-[(2,5-dimethylphenyl)methyl]piperidin-3-yl]-N-methylethanamine
CID 63853047
N-methyl-1-[1-(naphthalen-1-ylmethyl)piperidin-3-yl]ethanamine
CID 63854447
N-methyl-1-[1-(quinolin-2-ylmethyl)piperidin-3-yl]ethanamine
CID 63852699
4-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 110258581
4-[(3-methoxypiperidin-1-yl)methyl]pyridine
CID 131702809

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine?
The IUPAC name of N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine (CID 63854795) is N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine.
What is the SMILES notation for N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine?
The canonical SMILES for N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine is CNC(C)C1CCCN(Cc2ccncc2)C1.
What is the InChIKey of N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine?
The InChIKey is AOPYDHKNAFPFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-12(15-2)14-4-3-9-17(11-14)10-13-5-7-16-8-6-13/h5-8,12,14-15H,3-4,9-11H2,1-2H3.
What are the key properties of N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine?
N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine has a molecular weight of 233.36 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(pyridin-4-ylmethyl)piperidin-3-yl]ethanamine is sourced from PubChem (CID 63854795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).