1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide

C15H24N4O2 — CID 80631598

IUPAC1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide
SMILESCOCCNCc1ccc(N2CCC(C(N)=O)CC2)nc1
InChIInChI=1S/C15H24N4O2/c1-21-9-6-17-10-12-2-3-14(18-11-12)19-7-4-13(5-8-19)15(16)20/h2-3,11,13,17H,4-10H2,1H3,(H2,16,20)
InChIKeyOJYWZTPZBOZMAN-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.52
Rot. Bonds7

About 1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide

1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide (PubChem CID 80631598) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide
PubChem CID80631598
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide
SMILESCOCCNCc1ccc(N2CCC(C(N)=O)CC2)nc1
InChIInChI=1S/C15H24N4O2/c1-21-9-6-17-10-12-2-3-14(18-11-12)19-7-4-13(5-8-19)15(16)20/h2-3,11,13,17H,4-10H2,1H3,(H2,16,20)
InChIKeyOJYWZTPZBOZMAN-UHFFFAOYSA-N
XLogP0.52
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-N-[(6-piperidin-1-yl-3-pyridinyl)methyl]ethanamine
CID 80628704
1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]pyrrolidine-3,4-diol
CID 106670459
2-[4-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperazin-1-yl]ethanol
CID 80631144
N-[[6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methyl]-2-methoxyethanamine
CID 115560699
2-methoxy-N-[[6-(4-propylpiperazin-1-yl)-3-pyridinyl]methyl]ethanamine
CID 80631242
N-[[6-(3,4-dimethylpiperazin-1-yl)-3-pyridinyl]methyl]-2-methoxyethanamine
CID 80636085
[1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidin-2-yl]methanol
CID 80629858
2-methoxy-N-[[6-(2-methylazepan-1-yl)-3-pyridinyl]methyl]ethanamine
CID 80635743
N-[[6-(1,3-dihydroisoindol-2-yl)-3-pyridinyl]methyl]-2-methoxyethanamine
CID 80637880
8-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]-8-azabicyclo[3.2.1]octan-3-ol
CID 80638259
2-[[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]sulfanyl]acetamide
CID 114231429
2-methoxy-N-[[6-(2,2,6-trimethylmorpholin-4-yl)-3-pyridinyl]methyl]ethanamine
CID 80636499

Frequently Asked Questions

What is the IUPAC name of 1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide?
The IUPAC name of 1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide (CID 80631598) is 1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide is COCCNCc1ccc(N2CCC(C(N)=O)CC2)nc1.
What is the InChIKey of 1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide?
The InChIKey is OJYWZTPZBOZMAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-21-9-6-17-10-12-2-3-14(18-11-12)19-7-4-13(5-8-19)15(16)20/h2-3,11,13,17H,4-10H2,1H3,(H2,16,20).
What are the key properties of 1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide?
1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 0.52, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[(2-methoxyethylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide is sourced from PubChem (CID 80631598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).