N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide

C14H28N2O — CID 110753417

IUPACN,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide
SMILESCN(CCN1CCCCC1)C(=O)CC(C)(C)C
InChIInChI=1S/C14H28N2O/c1-14(2,3)12-13(17)15(4)10-11-16-8-6-5-7-9-16/h5-12H2,1-4H3
InChIKeyKHQUNTSSOZZBEK-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.37
Rot. Bonds4

About N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide

N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide (PubChem CID 110753417) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide.

Molecular Properties

Compound NameN,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide
PubChem CID110753417
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide
SMILESCN(CCN1CCCCC1)C(=O)CC(C)(C)C
InChIInChI=1S/C14H28N2O/c1-14(2,3)12-13(17)15(4)10-11-16-8-6-5-7-9-16/h5-12H2,1-4H3
InChIKeyKHQUNTSSOZZBEK-UHFFFAOYSA-N
XLogP2.37
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide?
The IUPAC name of N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide (CID 110753417) is N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide.
What is the SMILES notation for N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide?
The canonical SMILES for N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide is CN(CCN1CCCCC1)C(=O)CC(C)(C)C.
What is the InChIKey of N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide?
The InChIKey is KHQUNTSSOZZBEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-14(2,3)12-13(17)15(4)10-11-16-8-6-5-7-9-16/h5-12H2,1-4H3.
What are the key properties of N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide?
N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide has a molecular weight of 240.39 g/mol, XLogP of 2.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,3-trimethyl-N-(2-piperidin-1-ylethyl)butanamide is sourced from PubChem (CID 110753417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).