2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide

C13H26N2O — CID 25236580

IUPAC2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide
SMILESCC(C)N1CCC(NC(=O)C(C)(C)C)CC1
InChIInChI=1S/C13H26N2O/c1-10(2)15-8-6-11(7-9-15)14-12(16)13(3,4)5/h10-11H,6-9H2,1-5H3,(H,14,16)
InChIKeyZGXYZEGXMHESLY-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.02
Rot. Bonds2

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

2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide (PubChem CID 25236580) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide
PubChem CID25236580
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide
SMILESCC(C)N1CCC(NC(=O)C(C)(C)C)CC1
InChIInChI=1S/C13H26N2O/c1-10(2)15-8-6-11(7-9-15)14-12(16)13(3,4)5/h10-11H,6-9H2,1-5H3,(H,14,16)
InChIKeyZGXYZEGXMHESLY-UHFFFAOYSA-N
XLogP2.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide (CID 25236580) is 2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide is CC(C)N1CCC(NC(=O)C(C)(C)C)CC1.
What is the InChIKey of 2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide?
The InChIKey is ZGXYZEGXMHESLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-10(2)15-8-6-11(7-9-15)14-12(16)13(3,4)5/h10-11H,6-9H2,1-5H3,(H,14,16).
What are the key properties of 2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide?
2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide has a molecular weight of 226.36 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide is sourced from PubChem (CID 25236580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).