2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide

C15H24N4O — CID 65224805

IUPAC2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
SMILESCCC(CN)C(=O)Nc1ccc(N2CCCCC2)nc1
InChIInChI=1S/C15H24N4O/c1-2-12(10-16)15(20)18-13-6-7-14(17-11-13)19-8-4-3-5-9-19/h6-7,11-12H,2-5,8-10,16H2,1H3,(H,18,20)
InChIKeyOWPCJFAIRJCRJJ-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.00
Rot. Bonds5

About 2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide

2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide (PubChem CID 65224805) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
PubChem CID65224805
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
SMILESCCC(CN)C(=O)Nc1ccc(N2CCCCC2)nc1
InChIInChI=1S/C15H24N4O/c1-2-12(10-16)15(20)18-13-6-7-14(17-11-13)19-8-4-3-5-9-19/h6-7,11-12H,2-5,8-10,16H2,1H3,(H,18,20)
InChIKeyOWPCJFAIRJCRJJ-UHFFFAOYSA-N
XLogP2.00
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide?
The IUPAC name of 2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide (CID 65224805) is 2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide.
What is the SMILES notation for 2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide?
The canonical SMILES for 2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide is CCC(CN)C(=O)Nc1ccc(N2CCCCC2)nc1.
What is the InChIKey of 2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide?
The InChIKey is OWPCJFAIRJCRJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-2-12(10-16)15(20)18-13-6-7-14(17-11-13)19-8-4-3-5-9-19/h6-7,11-12H,2-5,8-10,16H2,1H3,(H,18,20).
What are the key properties of 2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide?
2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide has a molecular weight of 276.38 g/mol, XLogP of 2.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide is sourced from PubChem (CID 65224805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).