N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride

C15H31ClN2O — CID 3066159

IUPACN-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
SMILESCC(C)CCC(C)(C)NC(=O)CN1CCCCC1.Cl
InChIInChI=1S/C15H30N2O.ClH/c1-13(2)8-9-15(3,4)16-14(18)12-17-10-6-5-7-11-17;/h13H,5-12H2,1-4H3,(H,16,18);1H
InChIKeyDZHFKLQDEMGCGR-UHFFFAOYSA-N
MW290.88 g/mol
LogP3.23
Rot. Bonds6

About N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride

N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride (PubChem CID 3066159) has the molecular formula C15H31ClN2O and a molecular weight of 290.88 g/mol. Its IUPAC name is N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
PubChem CID3066159
Molecular FormulaC15H31ClN2O
Molecular Weight290.88 g/mol
Exact Mass290.21
IUPAC NameN-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
SMILESCC(C)CCC(C)(C)NC(=O)CN1CCCCC1.Cl
InChIInChI=1S/C15H30N2O.ClH/c1-13(2)8-9-15(3,4)16-14(18)12-17-10-6-5-7-11-17;/h13H,5-12H2,1-4H3,(H,16,18);1H
InChIKeyDZHFKLQDEMGCGR-UHFFFAOYSA-N
XLogP3.23
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.88
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The IUPAC name of N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride (CID 3066159) is N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride.
What is the SMILES notation for N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The canonical SMILES for N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride is CC(C)CCC(C)(C)NC(=O)CN1CCCCC1.Cl.
What is the InChIKey of N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The InChIKey is DZHFKLQDEMGCGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O.ClH/c1-13(2)8-9-15(3,4)16-14(18)12-17-10-6-5-7-11-17;/h13H,5-12H2,1-4H3,(H,16,18);1H.
What are the key properties of N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride has a molecular weight of 290.88 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride is sourced from PubChem (CID 3066159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).