2-methyl-N-(5-methylpiperidin-3-yl)propanamide

C10H20N2O — CID 107585162

IUPAC2-methyl-N-(5-methylpiperidin-3-yl)propanamide
SMILESCC1CNCC(NC(=O)C(C)C)C1
InChIInChI=1S/C10H20N2O/c1-7(2)10(13)12-9-4-8(3)5-11-6-9/h7-9,11H,4-6H2,1-3H3,(H,12,13)
InChIKeyXAFSMSAUZAZVRM-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.76
Rot. Bonds2

About 2-methyl-N-(5-methylpiperidin-3-yl)propanamide

2-methyl-N-(5-methylpiperidin-3-yl)propanamide (PubChem CID 107585162) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-methyl-N-(5-methylpiperidin-3-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(5-methylpiperidin-3-yl)propanamide
PubChem CID107585162
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2-methyl-N-(5-methylpiperidin-3-yl)propanamide
SMILESCC1CNCC(NC(=O)C(C)C)C1
InChIInChI=1S/C10H20N2O/c1-7(2)10(13)12-9-4-8(3)5-11-6-9/h7-9,11H,4-6H2,1-3H3,(H,12,13)
InChIKeyXAFSMSAUZAZVRM-UHFFFAOYSA-N
XLogP0.76
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(5-methylpiperidin-3-yl)propanamide?
The IUPAC name of 2-methyl-N-(5-methylpiperidin-3-yl)propanamide (CID 107585162) is 2-methyl-N-(5-methylpiperidin-3-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(5-methylpiperidin-3-yl)propanamide?
The canonical SMILES for 2-methyl-N-(5-methylpiperidin-3-yl)propanamide is CC1CNCC(NC(=O)C(C)C)C1.
What is the InChIKey of 2-methyl-N-(5-methylpiperidin-3-yl)propanamide?
The InChIKey is XAFSMSAUZAZVRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-7(2)10(13)12-9-4-8(3)5-11-6-9/h7-9,11H,4-6H2,1-3H3,(H,12,13).
What are the key properties of 2-methyl-N-(5-methylpiperidin-3-yl)propanamide?
2-methyl-N-(5-methylpiperidin-3-yl)propanamide has a molecular weight of 184.28 g/mol, XLogP of 0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(5-methylpiperidin-3-yl)propanamide is sourced from PubChem (CID 107585162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).