2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide

C14H22N4O — CID 115116266

IUPAC2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide
SMILESCN1CCC(NC(=O)c2ccnc(CCN)c2)CC1
InChIInChI=1S/C14H22N4O/c1-18-8-4-12(5-9-18)17-14(19)11-3-7-16-13(10-11)2-6-15/h3,7,10,12H,2,4-6,8-9,15H2,1H3,(H,17,19)
InChIKeyFVXODXYPPZXEJK-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.41
Rot. Bonds4

About 2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide

2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide (PubChem CID 115116266) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide
PubChem CID115116266
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide
SMILESCN1CCC(NC(=O)c2ccnc(CCN)c2)CC1
InChIInChI=1S/C14H22N4O/c1-18-8-4-12(5-9-18)17-14(19)11-3-7-16-13(10-11)2-6-15/h3,7,10,12H,2,4-6,8-9,15H2,1H3,(H,17,19)
InChIKeyFVXODXYPPZXEJK-UHFFFAOYSA-N
XLogP0.41
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide
CID 115116340
2-(2-hydroxyethyl)-N-(1-methylpyrrolidin-3-yl)pyridine-4-carboxamide
CID 115116342
2-bromo-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide
CID 103752018
2-(cyanomethyl)-N-(1-methylpyrrolidin-3-yl)pyridine-4-carboxamide
CID 115116174
2-(2-aminoethyl)-N-(2-cyclobutylethyl)pyridine-4-carboxamide
CID 115116320
2-(aminomethyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-4-carboxamide
CID 114325905
2-(aminomethyl)-N-(3-methylcyclohexyl)pyridine-4-carboxamide
CID 114325626
N-(4-aminocyclohexyl)-2-(4-methylpiperazin-1-yl)pyridine-4-carboxamide
CID 119478490
4-amino-3-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 43373277
4-amino-3-hydroxy-N-(1-methylpiperidin-4-yl)benzamide
CID 89070568
3,5-diamino-N-(1-methylpiperidin-4-yl)benzamide
CID 61094399
2-(2-aminoethyl)-N-(1H-pyrrol-3-yl)pyridine-4-carboxamide
CID 115116257

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide?
The IUPAC name of 2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide (CID 115116266) is 2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide is CN1CCC(NC(=O)c2ccnc(CCN)c2)CC1.
What is the InChIKey of 2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide?
The InChIKey is FVXODXYPPZXEJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-18-8-4-12(5-9-18)17-14(19)11-3-7-16-13(10-11)2-6-15/h3,7,10,12H,2,4-6,8-9,15H2,1H3,(H,17,19).
What are the key properties of 2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide?
2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 0.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide is sourced from PubChem (CID 115116266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).