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

C19H39ClN2O — CID 3066165

IUPACN-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
SMILESCCCCCCCCCC(C)(C)NC(=O)CN1CCCCC1.Cl
InChIInChI=1S/C19H38N2O.ClH/c1-4-5-6-7-8-9-11-14-19(2,3)20-18(22)17-21-15-12-10-13-16-21;/h4-17H2,1-3H3,(H,20,22);1H
InChIKeyIUWMRMJJEMNVGQ-UHFFFAOYSA-N
MW346.99 g/mol
LogP4.93
Rot. Bonds11

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

N-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride (PubChem CID 3066165) has the molecular formula C19H39ClN2O and a molecular weight of 346.99 g/mol. Its IUPAC name is N-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
PubChem CID3066165
Molecular FormulaC19H39ClN2O
Molecular Weight346.99 g/mol
Exact Mass346.28
IUPAC NameN-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride
SMILESCCCCCCCCCC(C)(C)NC(=O)CN1CCCCC1.Cl
InChIInChI=1S/C19H38N2O.ClH/c1-4-5-6-7-8-9-11-14-19(2,3)20-18(22)17-21-15-12-10-13-16-21;/h4-17H2,1-3H3,(H,20,22);1H
InChIKeyIUWMRMJJEMNVGQ-UHFFFAOYSA-N
XLogP4.93
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.99
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methylheptan-2-yl)-2-piperidin-1-ylacetamide
CID 3066164
N-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide
CID 3066158
2-pyrrolidin-1-yl-N-(2,4,4-trimethylpentan-2-yl)acetamide;hydrochloride
CID 24845344
2-(azepan-1-yl)-N-tert-butylacetamide
CID 18877375
N-dodecyl-2-piperidin-1-ylacetamide
CID 3064220
3-methyl-3-pentyl-1-pyrrolidin-1-ylnonan-2-one
CID 129054004
N-dodecyl-2-pyrrolidin-1-ylacetamide
CID 11971610
2-(azepan-1-yl)-N-pentylacetamide
CID 109006030
2-(1,4-diazepan-1-yl)-N-(2-methylbutan-2-yl)acetamide;hydrochloride
CID 119906765
N-(2-methylbutan-2-yl)-2-[4-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 30989737
2-(diethylamino)-N-(2-methylnonan-2-yl)acetamide;hydrochloride
CID 138396996
N-butyl-2-pyrrolidin-1-ylacetamide
CID 110687965

Frequently Asked Questions

What is the IUPAC name of N-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The IUPAC name of N-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride (CID 3066165) is N-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride.
What is the SMILES notation for N-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The canonical SMILES for N-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride is CCCCCCCCCC(C)(C)NC(=O)CN1CCCCC1.Cl.
What is the InChIKey of N-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
The InChIKey is IUWMRMJJEMNVGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2O.ClH/c1-4-5-6-7-8-9-11-14-19(2,3)20-18(22)17-21-15-12-10-13-16-21;/h4-17H2,1-3H3,(H,20,22);1H.
What are the key properties of N-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride?
N-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride has a molecular weight of 346.99 g/mol, XLogP of 4.93, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylundecan-2-yl)-2-piperidin-1-ylacetamide;hydrochloride is sourced from PubChem (CID 3066165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).