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

C17H26N4O2 — CID 18143999

IUPAC2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
SMILESCC(=O)NC(C(=O)Nc1ccc(N2CCCCC2)nc1)C(C)C
InChIInChI=1S/C17H26N4O2/c1-12(2)16(19-13(3)22)17(23)20-14-7-8-15(18-11-14)21-9-5-4-6-10-21/h7-8,11-12,16H,4-6,9-10H2,1-3H3,(H,19,22)(H,20,23)
InChIKeyGWGOYLLPGOOOMS-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.17
Rot. Bonds5

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

2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide (PubChem CID 18143999) has the molecular formula C17H26N4O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide.

Molecular Properties

Compound Name2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
PubChem CID18143999
Molecular FormulaC17H26N4O2
Molecular Weight318.42 g/mol
Exact Mass318.21
IUPAC Name2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
SMILESCC(=O)NC(C(=O)Nc1ccc(N2CCCCC2)nc1)C(C)C
InChIInChI=1S/C17H26N4O2/c1-12(2)16(19-13(3)22)17(23)20-14-7-8-15(18-11-14)21-9-5-4-6-10-21/h7-8,11-12,16H,4-6,9-10H2,1-3H3,(H,19,22)(H,20,23)
InChIKeyGWGOYLLPGOOOMS-UHFFFAOYSA-N
XLogP2.17
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[3-methyl-1-oxo-1-[(6-pyrrolidin-1-yl-3-pyridinyl)amino]butan-2-yl]benzamide
CID 46533335
2-methyl-N-[3-methyl-1-oxo-1-[(6-pyrrolidin-1-yl-3-pyridinyl)amino]butan-2-yl]benzamide
CID 43041619
N-[3-methyl-1-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]amino]-1-oxobutan-2-yl]cyclohexanecarboxamide
CID 24610805
3,5-dimethoxy-N-[(2S)-3-methyl-1-oxo-1-[(6-pyrrolidin-1-yl-3-pyridinyl)amino]butan-2-yl]benzamide
CID 31574700
(2R)-2-amino-3,3-dimethyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 103928716
(2S)-2-acetamido-N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-methylbutanamide
CID 31908169
(2R)-2-amino-3,3-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide
CID 103928713
4-amino-2-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 80543440
2-amino-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 43704585
2-(4-methylphenoxy)-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide
CID 43041620
2-(aminomethyl)-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 65224805
3-acetamido-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide
CID 47140496

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide?
The IUPAC name of 2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide (CID 18143999) is 2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide.
What is the SMILES notation for 2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide?
The canonical SMILES for 2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide is CC(=O)NC(C(=O)Nc1ccc(N2CCCCC2)nc1)C(C)C.
What is the InChIKey of 2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide?
The InChIKey is GWGOYLLPGOOOMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O2/c1-12(2)16(19-13(3)22)17(23)20-14-7-8-15(18-11-14)21-9-5-4-6-10-21/h7-8,11-12,16H,4-6,9-10H2,1-3H3,(H,19,22)(H,20,23).
What are the key properties of 2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide?
2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide has a molecular weight of 318.42 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-3-methyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide is sourced from PubChem (CID 18143999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).