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

C14H29ClN2O — CID 3065937

IUPACN-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
SMILESCCCCC(C)(C)NC(=O)CN1CCCCC1.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-4-5-9-14(2,3)15-13(17)12-16-10-7-6-8-11-16;/h4-12H2,1-3H3,(H,15,17);1H
InChIKeyDNCLZYVCDJLCKQ-UHFFFAOYSA-N
MW276.85 g/mol
LogP2.98
Rot. Bonds6

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

N-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride (PubChem CID 3065937) has the molecular formula C14H29ClN2O and a molecular weight of 276.85 g/mol. Its IUPAC name is N-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
PubChem CID3065937
Molecular FormulaC14H29ClN2O
Molecular Weight276.85 g/mol
Exact Mass276.20
IUPAC NameN-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
SMILESCCCCC(C)(C)NC(=O)CN1CCCCC1.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-4-5-9-14(2,3)15-13(17)12-16-10-7-6-8-11-16;/h4-12H2,1-3H3,(H,15,17);1H
InChIKeyDNCLZYVCDJLCKQ-UHFFFAOYSA-N
XLogP2.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.85
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The IUPAC name of N-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride (CID 3065937) is N-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride.
What is the SMILES notation for N-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The canonical SMILES for N-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride is CCCCC(C)(C)NC(=O)CN1CCCCC1.Cl.
What is the InChIKey of N-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The InChIKey is DNCLZYVCDJLCKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O.ClH/c1-4-5-9-14(2,3)15-13(17)12-16-10-7-6-8-11-16;/h4-12H2,1-3H3,(H,15,17);1H.
What are the key properties of N-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
N-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride has a molecular weight of 276.85 g/mol, XLogP of 2.98, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylhexan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride is sourced from PubChem (CID 3065937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).