2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide

C13H20N4O — CID 62475541

IUPAC2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide
SMILESCc1cc(N)cnc1N1CCC(CC(N)=O)CC1
InChIInChI=1S/C13H20N4O/c1-9-6-11(14)8-16-13(9)17-4-2-10(3-5-17)7-12(15)18/h6,8,10H,2-5,7,14H2,1H3,(H2,15,18)
InChIKeyWBQSURKNVVRGJA-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.06
Rot. Bonds3

About 2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide

2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide (PubChem CID 62475541) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide
PubChem CID62475541
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide
SMILESCc1cc(N)cnc1N1CCC(CC(N)=O)CC1
InChIInChI=1S/C13H20N4O/c1-9-6-11(14)8-16-13(9)17-4-2-10(3-5-17)7-12(15)18/h6,8,10H,2-5,7,14H2,1H3,(H2,15,18)
InChIKeyWBQSURKNVVRGJA-UHFFFAOYSA-N
XLogP1.06
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide (CID 62475541) is 2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide is Cc1cc(N)cnc1N1CCC(CC(N)=O)CC1.
What is the InChIKey of 2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide?
The InChIKey is WBQSURKNVVRGJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-9-6-11(14)8-16-13(9)17-4-2-10(3-5-17)7-12(15)18/h6,8,10H,2-5,7,14H2,1H3,(H2,15,18).
What are the key properties of 2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide?
2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(5-amino-3-methyl-2-pyridinyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 62475541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).