2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide

C12H24N2O — CID 25236583

IUPAC2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide
SMILESCC(C)C(=O)NC1CCN(C(C)C)CC1
InChIInChI=1S/C12H24N2O/c1-9(2)12(15)13-11-5-7-14(8-6-11)10(3)4/h9-11H,5-8H2,1-4H3,(H,13,15)
InChIKeyIBKHNBXRNXZENX-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.63
Rot. Bonds3

About 2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide

2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide (PubChem CID 25236583) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide
PubChem CID25236583
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide
SMILESCC(C)C(=O)NC1CCN(C(C)C)CC1
InChIInChI=1S/C12H24N2O/c1-9(2)12(15)13-11-5-7-14(8-6-11)10(3)4/h9-11H,5-8H2,1-4H3,(H,13,15)
InChIKeyIBKHNBXRNXZENX-UHFFFAOYSA-N
XLogP1.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide?
The IUPAC name of 2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide (CID 25236583) is 2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide?
The canonical SMILES for 2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide is CC(C)C(=O)NC1CCN(C(C)C)CC1.
What is the InChIKey of 2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide?
The InChIKey is IBKHNBXRNXZENX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9(2)12(15)13-11-5-7-14(8-6-11)10(3)4/h9-11H,5-8H2,1-4H3,(H,13,15).
What are the key properties of 2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide?
2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide has a molecular weight of 212.34 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide is sourced from PubChem (CID 25236583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).