4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide

C15H24N4O — CID 63855111

IUPAC4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide
SMILESCCCNCC1CCCCN1c1ccnc(C(N)=O)c1
InChIInChI=1S/C15H24N4O/c1-2-7-17-11-13-5-3-4-9-19(13)12-6-8-18-14(10-12)15(16)20/h6,8,10,13,17H,2-5,7,9,11H2,1H3,(H2,16,20)
InChIKeyRYEIBSXMGIFSSO-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.54
Rot. Bonds6

About 4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide

4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide (PubChem CID 63855111) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide
PubChem CID63855111
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide
SMILESCCCNCC1CCCCN1c1ccnc(C(N)=O)c1
InChIInChI=1S/C15H24N4O/c1-2-7-17-11-13-5-3-4-9-19(13)12-6-8-18-14(10-12)15(16)20/h6,8,10,13,17H,2-5,7,9,11H2,1H3,(H2,16,20)
InChIKeyRYEIBSXMGIFSSO-UHFFFAOYSA-N
XLogP1.54
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109202928
4-[2-[1-(ethylamino)ethyl]piperidin-1-yl]pyridine-2-carboxamide
CID 63855097
[4-(2-ethylpiperidin-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109203690
4-[2-(2-aminoethyl)piperidin-1-yl]-N-ethylpyridine-2-carboxamide
CID 63766258
[1-[2-(propylamino)-4-pyridinyl]azepan-2-yl]methanol
CID 116640752
N-[[1-(4-methylsulfonylphenyl)piperidin-2-yl]methyl]propan-1-amine
CID 62592530
4-[2-(hydroxymethyl)azepan-1-yl]pyridine-2-carbothioamide
CID 116634846
N-ethyl-4-[2-(hydroxymethyl)pyrrolidin-1-yl]pyridine-2-carboxamide
CID 61409376
1-(2-carbamoyl-4-pyridinyl)pyrrolidine-2-carboxylic acid
CID 43517516
4-[2-(hydroxymethyl)piperidin-1-yl]pyridine-2-carboximidamide
CID 62924925
N-(4-ethoxyphenyl)-4-(2-ethylpiperidin-1-yl)pyridine-2-carboxamide
CID 109218049
N-methyl-4-[3-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide
CID 63853891

Frequently Asked Questions

What is the IUPAC name of 4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide?
The IUPAC name of 4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide (CID 63855111) is 4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide.
What is the SMILES notation for 4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide?
The canonical SMILES for 4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide is CCCNCC1CCCCN1c1ccnc(C(N)=O)c1.
What is the InChIKey of 4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide?
The InChIKey is RYEIBSXMGIFSSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-2-7-17-11-13-5-3-4-9-19(13)12-6-8-18-14(10-12)15(16)20/h6,8,10,13,17H,2-5,7,9,11H2,1H3,(H2,16,20).
What are the key properties of 4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide?
4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide is sourced from PubChem (CID 63855111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).