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

C14H23N3 — CID 62592708

IUPACN-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine
SMILESCCNCC1CCCN(c2cc(C)ccn2)C1
InChIInChI=1S/C14H23N3/c1-3-15-10-13-5-4-8-17(11-13)14-9-12(2)6-7-16-14/h6-7,9,13,15H,3-5,8,10-11H2,1-2H3
InChIKeyXEOMJVLNWCQEPB-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.22
Rot. Bonds4

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

N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine (PubChem CID 62592708) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine
PubChem CID62592708
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine
SMILESCCNCC1CCCN(c2cc(C)ccn2)C1
InChIInChI=1S/C14H23N3/c1-3-15-10-13-5-4-8-17(11-13)14-9-12(2)6-7-16-14/h6-7,9,13,15H,3-5,8,10-11H2,1-2H3
InChIKeyXEOMJVLNWCQEPB-UHFFFAOYSA-N
XLogP2.22
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 ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]ethanamine
CID 106550545
N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine
CID 62547429
ethane;2-(3-ethylpyrrolidin-1-yl)-4-methylpyridine
CID 170578415
[(3S)-1-(4-methyl-2-pyridinyl)pyrrolidin-3-yl]methanol
CID 94407847
N-ethyl-1-[1-(4-methyl-2-pyridinyl)piperidin-3-yl]ethanamine
CID 63854038
N-[[1-(6-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine
CID 62592540
4-[3-(ethylaminomethyl)piperidin-1-yl]-1H-pyrimidin-6-one
CID 136989738
N-[(1-pyridin-4-ylpiperidin-3-yl)methyl]ethanamine
CID 62592344
N-[[1-(6-propoxypyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine
CID 66331580
tert-butyl N-[[(3S)-1-(4-methyl-2-pyridinyl)pyrrolidin-3-yl]methyl]carbamate
CID 97176211
1-(4-methyl-2-pyridinyl)pyrrolidin-3-ol
CID 62917147
2-methyl-N-[[1-(4-methyl-2-pyridinyl)piperidin-4-yl]methyl]propan-1-amine
CID 62593726

Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine?
The IUPAC name of N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine (CID 62592708) is N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine is CCNCC1CCCN(c2cc(C)ccn2)C1.
What is the InChIKey of N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine?
The InChIKey is XEOMJVLNWCQEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-15-10-13-5-4-8-17(11-13)14-9-12(2)6-7-16-14/h6-7,9,13,15H,3-5,8,10-11H2,1-2H3.
What are the key properties of N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine?
N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine has a molecular weight of 233.36 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(4-methyl-2-pyridinyl)piperidin-3-yl]methyl]ethanamine is sourced from PubChem (CID 62592708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).