N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride

C16H33ClN2O — CID 3066181

IUPACN-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
SMILESCCCCCCC(C)(C)NC(=O)CN1CCCCC1.Cl
InChIInChI=1S/C16H32N2O.ClH/c1-4-5-6-8-11-16(2,3)17-15(19)14-18-12-9-7-10-13-18;/h4-14H2,1-3H3,(H,17,19);1H
InChIKeyZHTKFFNWTRZUCQ-UHFFFAOYSA-N
MW304.91 g/mol
LogP3.76
Rot. Bonds8

About N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride

N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride (PubChem CID 3066181) has the molecular formula C16H33ClN2O and a molecular weight of 304.91 g/mol. Its IUPAC name is N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
PubChem CID3066181
Molecular FormulaC16H33ClN2O
Molecular Weight304.91 g/mol
Exact Mass304.23
IUPAC NameN-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
SMILESCCCCCCC(C)(C)NC(=O)CN1CCCCC1.Cl
InChIInChI=1S/C16H32N2O.ClH/c1-4-5-6-8-11-16(2,3)17-15(19)14-18-12-9-7-10-13-18;/h4-14H2,1-3H3,(H,17,19);1H
InChIKeyZHTKFFNWTRZUCQ-UHFFFAOYSA-N
XLogP3.76
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.91
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The IUPAC name of N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride (CID 3066181) is N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride.
What is the SMILES notation for N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The canonical SMILES for N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride is CCCCCCC(C)(C)NC(=O)CN1CCCCC1.Cl.
What is the InChIKey of N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The InChIKey is ZHTKFFNWTRZUCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O.ClH/c1-4-5-6-8-11-16(2,3)17-15(19)14-18-12-9-7-10-13-18;/h4-14H2,1-3H3,(H,17,19);1H.
What are the key properties of N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride has a molecular weight of 304.91 g/mol, XLogP of 3.76, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyloctan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride is sourced from PubChem (CID 3066181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).