2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide

C13H25N3O2 — CID 60751395

IUPAC2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide
SMILESCNC(=O)CN1CCC(NC(=O)C(C)(C)C)CC1
InChIInChI=1S/C13H25N3O2/c1-13(2,3)12(18)15-10-5-7-16(8-6-10)9-11(17)14-4/h10H,5-9H2,1-4H3,(H,14,17)(H,15,18)
InChIKeyDEOSAGMUKVWZHO-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.36
Rot. Bonds3

About 2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide

2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide (PubChem CID 60751395) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide
PubChem CID60751395
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide
SMILESCNC(=O)CN1CCC(NC(=O)C(C)(C)C)CC1
InChIInChI=1S/C13H25N3O2/c1-13(2,3)12(18)15-10-5-7-16(8-6-10)9-11(17)14-4/h10H,5-9H2,1-4H3,(H,14,17)(H,15,18)
InChIKeyDEOSAGMUKVWZHO-UHFFFAOYSA-N
XLogP0.36
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide (CID 60751395) is 2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide is CNC(=O)CN1CCC(NC(=O)C(C)(C)C)CC1.
What is the InChIKey of 2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide?
The InChIKey is DEOSAGMUKVWZHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-13(2,3)12(18)15-10-5-7-16(8-6-10)9-11(17)14-4/h10H,5-9H2,1-4H3,(H,14,17)(H,15,18).
What are the key properties of 2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide?
2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide has a molecular weight of 255.36 g/mol, XLogP of 0.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide is sourced from PubChem (CID 60751395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).