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

C15H31ClN2O2 — CID 3066157

IUPACN-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride
SMILESCCCCCCC(C)(C)NC(=O)CN1CCOCC1.Cl
InChIInChI=1S/C15H30N2O2.ClH/c1-4-5-6-7-8-15(2,3)16-14(18)13-17-9-11-19-12-10-17;/h4-13H2,1-3H3,(H,16,18);1H
InChIKeyGCWJZQIACAGETN-UHFFFAOYSA-N
MW306.88 g/mol
LogP2.61
Rot. Bonds8

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

N-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride (PubChem CID 3066157) has the molecular formula C15H31ClN2O2 and a molecular weight of 306.88 g/mol. Its IUPAC name is N-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride
PubChem CID3066157
Molecular FormulaC15H31ClN2O2
Molecular Weight306.88 g/mol
Exact Mass306.21
IUPAC NameN-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride
SMILESCCCCCCC(C)(C)NC(=O)CN1CCOCC1.Cl
InChIInChI=1S/C15H30N2O2.ClH/c1-4-5-6-7-8-15(2,3)16-14(18)13-17-9-11-19-12-10-17;/h4-13H2,1-3H3,(H,16,18);1H
InChIKeyGCWJZQIACAGETN-UHFFFAOYSA-N
XLogP2.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.88
LogP ≤ 52.61
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-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
The IUPAC name of N-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride (CID 3066157) is N-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride.
What is the SMILES notation for N-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
The canonical SMILES for N-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride is CCCCCCC(C)(C)NC(=O)CN1CCOCC1.Cl.
What is the InChIKey of N-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
The InChIKey is GCWJZQIACAGETN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2.ClH/c1-4-5-6-7-8-15(2,3)16-14(18)13-17-9-11-19-12-10-17;/h4-13H2,1-3H3,(H,16,18);1H.
What are the key properties of N-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride?
N-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride has a molecular weight of 306.88 g/mol, XLogP of 2.61, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyloctan-2-yl)-2-morpholin-4-ylacetamide;hydrochloride is sourced from PubChem (CID 3066157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).