2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine

C15H26N4 — CID 116907378

IUPAC2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine
SMILESCN(C)C(c1cccnc1)C1CCN(CCN)CC1
InChIInChI=1S/C15H26N4/c1-18(2)15(14-4-3-8-17-12-14)13-5-9-19(10-6-13)11-7-16/h3-4,8,12-13,15H,5-7,9-11,16H2,1-2H3
InChIKeyUHUVWYXQNGKDJS-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.36
Rot. Bonds5

About 2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine

2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine (PubChem CID 116907378) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine
PubChem CID116907378
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine
SMILESCN(C)C(c1cccnc1)C1CCN(CCN)CC1
InChIInChI=1S/C15H26N4/c1-18(2)15(14-4-3-8-17-12-14)13-5-9-19(10-6-13)11-7-16/h3-4,8,12-13,15H,5-7,9-11,16H2,1-2H3
InChIKeyUHUVWYXQNGKDJS-UHFFFAOYSA-N
XLogP1.36
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-propylpiperidin-4-yl)-N-(1-pyridin-3-ylethyl)ethanamine
CID 43308271
N-methyl-1-pyridin-3-yl-N-(2-pyrrolidin-1-ylethyl)ethane-1,2-diamine
CID 63207068
[1-[2-(3,5-dimethylpyrazol-1-yl)ethyl]piperidin-4-yl]-pyridin-3-ylmethanol
CID 171915677
1-[1-(2-pyridin-3-ylethyl)piperidin-4-yl]ethanamine;dihydrochloride
CID 119920848
2-[1-[2-[phenyl(pyridin-3-yl)methyl]sulfanylethyl]piperidin-4-yl]ethanamine
CID 67811373
2-(3-benzhydrylpyrrolidin-1-yl)ethanamine
CID 131855350
N-cyclopropyl-N-propyl-1-pyridin-3-ylethane-1,2-diamine
CID 43270152
1-[(2R)-2-pyridin-3-ylpropyl]piperazine
CID 67593511
1-N-methyl-1-N-(1-methylpiperidin-3-yl)-1-pyridin-3-ylbutane-1,2-diamine
CID 62546038
2-(dimethylamino)-1-(4-ethylpiperazin-1-yl)-2-pyridin-3-ylethanone
CID 110753896
2-(2-ethylpiperidin-1-yl)-2-pyridin-3-ylethanamine
CID 43266319
(2R)-2-[[1-(2-amino-2-oxoethyl)piperidine-4-carbonyl]-methylamino]-2-pyridin-3-ylacetic acid
CID 97284989

Frequently Asked Questions

What is the IUPAC name of 2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine?
The IUPAC name of 2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine (CID 116907378) is 2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine.
What is the SMILES notation for 2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine?
The canonical SMILES for 2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine is CN(C)C(c1cccnc1)C1CCN(CCN)CC1.
What is the InChIKey of 2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine?
The InChIKey is UHUVWYXQNGKDJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-18(2)15(14-4-3-8-17-12-14)13-5-9-19(10-6-13)11-7-16/h3-4,8,12-13,15H,5-7,9-11,16H2,1-2H3.
What are the key properties of 2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine?
2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine has a molecular weight of 262.40 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[dimethylamino(pyridin-3-yl)methyl]piperidin-1-yl]ethanamine is sourced from PubChem (CID 116907378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).