4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide

C14H29N3O — CID 63159082

IUPAC4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide
SMILESCCC1(C)CCN(CCC(C)(NC)C(N)=O)CC1
InChIInChI=1S/C14H29N3O/c1-5-13(2)6-9-17(10-7-13)11-8-14(3,16-4)12(15)18/h16H,5-11H2,1-4H3,(H2,15,18)
InChIKeyIRHPQMWBJHNMSW-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.35
Rot. Bonds6

About 4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide

4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide (PubChem CID 63159082) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide.

Molecular Properties

Compound Name4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide
PubChem CID63159082
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide
SMILESCCC1(C)CCN(CCC(C)(NC)C(N)=O)CC1
InChIInChI=1S/C14H29N3O/c1-5-13(2)6-9-17(10-7-13)11-8-14(3,16-4)12(15)18/h16H,5-11H2,1-4H3,(H2,15,18)
InChIKeyIRHPQMWBJHNMSW-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide?
The IUPAC name of 4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide (CID 63159082) is 4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide.
What is the SMILES notation for 4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide?
The canonical SMILES for 4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide is CCC1(C)CCN(CCC(C)(NC)C(N)=O)CC1.
What is the InChIKey of 4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide?
The InChIKey is IRHPQMWBJHNMSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-5-13(2)6-9-17(10-7-13)11-8-14(3,16-4)12(15)18/h16H,5-11H2,1-4H3,(H2,15,18).
What are the key properties of 4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide?
4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide has a molecular weight of 255.41 g/mol, XLogP of 1.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethyl-4-methylpiperidin-1-yl)-2-methyl-2-(methylamino)butanamide is sourced from PubChem (CID 63159082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).