N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine

C15H25N3 — CID 83131415

IUPACN-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine
SMILESCCNC(C)c1ccc(N2CCC(C)CC2)cn1
InChIInChI=1S/C15H25N3/c1-4-16-13(3)15-6-5-14(11-17-15)18-9-7-12(2)8-10-18/h5-6,11-13,16H,4,7-10H2,1-3H3
InChIKeyCVJWHUFHOTVAIK-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.99
Rot. Bonds4

About N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine

N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine (PubChem CID 83131415) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine
PubChem CID83131415
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine
SMILESCCNC(C)c1ccc(N2CCC(C)CC2)cn1
InChIInChI=1S/C15H25N3/c1-4-16-13(3)15-6-5-14(11-17-15)18-9-7-12(2)8-10-18/h5-6,11-13,16H,4,7-10H2,1-3H3
InChIKeyCVJWHUFHOTVAIK-UHFFFAOYSA-N
XLogP2.99
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-[1-(ethylamino)ethyl]-3-pyridinyl]piperidin-4-ol
CID 83122376
N-ethyl-1-(5-morpholin-4-yl-2-pyridinyl)ethanamine
CID 83122280
1-[5-(2,4-dimethylpiperidin-1-yl)-2-pyridinyl]-N-ethylethanamine
CID 83121863
1-[5-(4-tert-butylpiperazin-1-yl)-2-pyridinyl]-N-ethylethanamine
CID 83111380
1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-ol
CID 112585215
(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanol
CID 83132436
1-[5-(2,5-dimethylpiperidin-1-yl)-2-pyridinyl]-N-ethylethanamine
CID 83127474
1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]-N-propylpropan-1-amine
CID 115939163
(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine
CID 103936871
N-[1-[5-(4-methoxypiperidin-1-yl)-2-pyridinyl]ethyl]propan-1-amine
CID 83122477
1-[5-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-pyridinyl]-N-ethylethanamine
CID 83109204
1-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-pyridinyl]-N-ethylethanamine
CID 83111170

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine?
The IUPAC name of N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine (CID 83131415) is N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine.
What is the SMILES notation for N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine?
The canonical SMILES for N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine is CCNC(C)c1ccc(N2CCC(C)CC2)cn1.
What is the InChIKey of N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine?
The InChIKey is CVJWHUFHOTVAIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-16-13(3)15-6-5-14(11-17-15)18-9-7-12(2)8-10-18/h5-6,11-13,16H,4,7-10H2,1-3H3.
What are the key properties of N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine?
N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine has a molecular weight of 247.39 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine is sourced from PubChem (CID 83131415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).