N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride

C17H35ClN2O2 — CID 3066762

IUPACN-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride
SMILESCCCCCCCCC(C)(C)NC(=O)CN1CCOCC1.Cl
InChIInChI=1S/C17H34N2O2.ClH/c1-4-5-6-7-8-9-10-17(2,3)18-16(20)15-19-11-13-21-14-12-19;/h4-15H2,1-3H3,(H,18,20);1H
InChIKeyCQXFRUILIOVNBT-UHFFFAOYSA-N
MW334.93 g/mol
LogP3.39
Rot. Bonds10

About N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride

N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride (PubChem CID 3066762) has the molecular formula C17H35ClN2O2 and a molecular weight of 334.93 g/mol. Its IUPAC name is N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride
PubChem CID3066762
Molecular FormulaC17H35ClN2O2
Molecular Weight334.93 g/mol
Exact Mass334.24
IUPAC NameN-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride
SMILESCCCCCCCCC(C)(C)NC(=O)CN1CCOCC1.Cl
InChIInChI=1S/C17H34N2O2.ClH/c1-4-5-6-7-8-9-10-17(2,3)18-16(20)15-19-11-13-21-14-12-19;/h4-15H2,1-3H3,(H,18,20);1H
InChIKeyCQXFRUILIOVNBT-UHFFFAOYSA-N
XLogP3.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.93
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
The IUPAC name of N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride (CID 3066762) is N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride.
What is the SMILES notation for N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
The canonical SMILES for N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride is CCCCCCCCC(C)(C)NC(=O)CN1CCOCC1.Cl.
What is the InChIKey of N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
The InChIKey is CQXFRUILIOVNBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2.ClH/c1-4-5-6-7-8-9-10-17(2,3)18-16(20)15-19-11-13-21-14-12-19;/h4-15H2,1-3H3,(H,18,20);1H.
What are the key properties of N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride has a molecular weight of 334.93 g/mol, XLogP of 3.39, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyldecan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride is sourced from PubChem (CID 3066762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).